				60			
Bg, (1.04 THz), IR inactive jmolscript: load "" {2 3 1} spacegroup "x,y,z" unitcell {5.908055  5.409125  23.312212  90.0 93.423203  90.0}; select all;vibration period 1; vibration scale 0.4; vibration on;   vector scale 1; vector on; select molecule = 6;color yellow; select molecule = 20;color yellow;color yellow; select none 
H	2.636038	2.841927	1.306092		0.390061	-0.262845	-0.110557
H	3.356104	4.417292	3.058800		0.663260	-0.428995	-0.079762
H	2.033967	4.641224	5.132544		0.836225	-0.408688	0.023626
H	-0.015229	3.297549	5.438473		0.730838	-0.231254	0.105436
H	-0.732874	1.729957	3.670359		0.462959	-0.086336	0.080915
H	-0.766176	-0.109805	0.833090		0.109503	-0.010540	0.069994
H	2.342432	5.546490	10.431063		0.390061	0.262845	-0.110557
H	1.622367	7.121854	8.678355		0.663259	0.428995	-0.079762
H	2.944504	7.345787	6.604612		0.836225	0.408688	0.023626
H	4.993699	6.002111	6.298682		0.730838	0.231254	0.105436
H	5.711345	4.434520	8.066796		0.462959	0.086336	0.080915
H	5.744647	2.594757	10.904065		0.109503	0.010540	0.069994
H	1.414028	2.567198	22.050136		-0.390061	0.262845	0.110557
H	0.693962	0.991833	20.297429		-0.663260	0.428995	0.079762
H	2.016099	0.767901	18.223685		-0.836225	0.408688	-0.023626
H	4.065294	2.111576	17.917755		-0.730838	0.231254	-0.105436
H	4.782940	3.679168	19.685870		-0.462959	0.086336	-0.080915
H	4.816242	5.518930	22.523138		-0.109503	0.010540	-0.069994
H	1.707633	-0.137365	12.925166		-0.390061	-0.262845	0.110557
H	2.427699	-1.712729	14.677873		-0.663259	-0.428995	0.079762
H	1.105562	-1.936662	16.751617		-0.836225	-0.408688	-0.023626
H	-0.943633	-0.592986	17.057547		-0.730838	-0.231254	-0.105436
H	-1.661279	0.974605	15.289433		-0.462959	-0.086336	-0.080915
H	-1.694581	2.814368	12.452164		-0.109503	-0.010540	-0.069994
C	0.504476	1.247582	1.323252		0.230499	-0.075679	-0.025662
C	0.911312	2.186038	2.385754		0.410233	-0.168573	-0.015645
C	2.060337	2.946578	2.215307		0.464586	-0.263634	-0.064293
C	2.461350	3.825160	3.199930		0.619416	-0.353900	-0.047288
C	1.718447	3.949813	4.360759		0.718218	-0.345851	0.014665
C	0.570737	3.195965	4.533631		0.656224	-0.244846	0.058518
C	0.166542	2.317166	3.550619		0.506476	-0.160333	0.045339
C	4.473995	3.952145	10.413903		0.230499	0.075679	-0.025662
C	4.067158	4.890601	9.351401		0.410233	0.168573	-0.015645
C	2.918134	5.651140	9.521849		0.464586	0.263634	-0.064293
C	2.517120	6.529723	8.537225		0.619416	0.353900	-0.047288
C	3.260024	6.654376	7.376396		0.718218	0.345851	0.014665
C	4.407733	5.900528	7.203525		0.656224	0.244846	0.058518
C	4.811928	5.021729	8.186536		0.506476	0.160333	0.045339
C	3.545590	4.161543	22.032977		-0.230499	0.075679	0.025662
C	3.138753	3.223087	20.970474		-0.410233	0.168573	0.015645
C	1.989729	2.462547	21.140922		-0.464586	0.263634	0.064293
C	1.588715	1.583965	20.156299		-0.619416	0.353900	0.047288
C	2.331619	1.459312	18.995470		-0.718218	0.345851	-0.014665
C	3.479328	2.213160	18.822598		-0.656224	0.244846	-0.058518
C	3.883524	3.091959	19.805609		-0.506476	0.160333	-0.045339
C	-0.423929	1.456980	12.942325		-0.230499	-0.075679	0.025662
C	-0.017093	0.518524	14.004828		-0.410233	-0.168573	0.015645
C	1.131932	-0.242015	13.834380		-0.464586	-0.263634	0.064293
C	1.532946	-1.120598	14.819003		-0.619416	-0.353900	0.047288
C	0.790042	-1.245251	15.979833		-0.718218	-0.345851	-0.014665
C	-0.357667	-0.491403	16.152704		-0.656224	-0.244846	-0.058518
C	-0.761863	0.387396	15.169693		-0.506476	-0.160333	-0.045339
O	1.129086	1.151197	0.272338		0.080324	-0.028712	-0.120052
O	-0.555862	0.537386	1.592833		0.237700	-0.047885	0.069892
O	3.849385	3.855760	11.464817		0.080324	0.028712	-0.120052
O	5.534333	3.241948	10.144322		0.237700	0.047885	0.069892
O	2.920980	4.257928	23.083891		-0.080324	0.028712	0.120052
O	4.605928	4.871739	21.763396		-0.237700	0.047885	-0.069892
O	0.200681	1.553366	11.891411		-0.080324	-0.028712	0.120052
O	-1.484267	2.167177	13.211906		-0.237700	-0.047885	-0.069892
				60			
Ag, (1.05 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.261319	-0.172929	-0.094488
H	3.356104	4.417292	3.058800		0.516168	-0.394883	-0.004116
H	2.033967	4.641224	5.132544		0.759489	-0.576085	0.171578
H	-0.015229	3.297549	5.438473		0.740943	-0.530589	0.254316
H	-0.732874	1.729957	3.670359		0.485436	-0.309650	0.162742
H	-0.766176	-0.109805	0.833090		0.092742	-0.047195	0.046586
H	2.342432	5.546490	10.431063		-0.261319	-0.172929	0.094488
H	1.622367	7.121854	8.678355		-0.516168	-0.394883	0.004116
H	2.944504	7.345787	6.604612		-0.759489	-0.576085	-0.171578
H	4.993699	6.002111	6.298682		-0.740943	-0.530589	-0.254316
H	5.711345	4.434520	8.066796		-0.485436	-0.309650	-0.162742
H	5.744647	2.594757	10.904065		-0.092742	-0.047195	-0.046586
H	1.414028	2.567198	22.050136		-0.261319	0.172929	0.094488
H	0.693962	0.991833	20.297429		-0.516168	0.394883	0.004116
H	2.016099	0.767901	18.223685		-0.759489	0.576085	-0.171578
H	4.065294	2.111576	17.917755		-0.740943	0.530589	-0.254316
H	4.782940	3.679168	19.685870		-0.485436	0.309650	-0.162742
H	4.816242	5.518930	22.523138		-0.092742	0.047195	-0.046586
H	1.707633	-0.137365	12.925166		0.261319	0.172929	-0.094488
H	2.427699	-1.712729	14.677873		0.516168	0.394883	-0.004116
H	1.105562	-1.936662	16.751617		0.759489	0.576085	0.171578
H	-0.943633	-0.592986	17.057547		0.740943	0.530589	0.254316
H	-1.661279	0.974605	15.289433		0.485436	0.309650	0.162742
H	-1.694581	2.814368	12.452164		0.092742	0.047195	0.046586
C	0.504476	1.247582	1.323252		0.193853	-0.104722	-0.006919
C	0.911312	2.186038	2.385754		0.357473	-0.226390	0.030447
C	2.060337	2.946578	2.215307		0.364942	-0.251383	-0.020662
C	2.461350	3.825160	3.199930		0.508591	-0.374817	0.029547
C	1.718447	3.949813	4.360759		0.646153	-0.475084	0.128048
C	0.570737	3.195965	4.533631		0.633792	-0.449300	0.175442
C	0.166542	2.317166	3.550619		0.490896	-0.326302	0.126135
C	4.473995	3.952145	10.413903		-0.193853	-0.104722	0.006919
C	4.067158	4.890601	9.351401		-0.357473	-0.226390	-0.030447
C	2.918134	5.651140	9.521849		-0.364942	-0.251383	0.020662
C	2.517120	6.529723	8.537225		-0.508591	-0.374817	-0.029547
C	3.260024	6.654376	7.376396		-0.646153	-0.475084	-0.128048
C	4.407733	5.900528	7.203525		-0.633792	-0.449300	-0.175442
C	4.811928	5.021729	8.186536		-0.490896	-0.326302	-0.126135
C	3.545590	4.161543	22.032977		-0.193853	0.104722	0.006919
C	3.138753	3.223087	20.970474		-0.357473	0.226390	-0.030447
C	1.989729	2.462547	21.140922		-0.364942	0.251383	0.020662
C	1.588715	1.583965	20.156299		-0.508591	0.374817	-0.029547
C	2.331619	1.459312	18.995470		-0.646153	0.475084	-0.128048
C	3.479328	2.213160	18.822598		-0.633792	0.449300	-0.175442
C	3.883524	3.091959	19.805609		-0.490896	0.326302	-0.126135
C	-0.423929	1.456980	12.942325		0.193853	0.104722	-0.006919
C	-0.017093	0.518524	14.004828		0.357473	0.226390	0.030447
C	1.131932	-0.242015	13.834380		0.364942	0.251383	-0.020662
C	1.532946	-1.120598	14.819003		0.508591	0.374817	0.029547
C	0.790042	-1.245251	15.979833		0.646153	0.475084	0.128048
C	-0.357667	-0.491403	16.152704		0.633792	0.449300	0.175442
C	-0.761863	0.387396	15.169693		0.490896	0.326302	0.126135
O	1.129086	1.151197	0.272338		0.060445	-0.025451	-0.095549
O	-0.555862	0.537386	1.592833		0.204300	-0.088497	0.059900
O	3.849385	3.855760	11.464817		-0.060445	-0.025451	0.095549
O	5.534333	3.241948	10.144322		-0.204300	-0.088497	-0.059900
O	2.920980	4.257928	23.083891		-0.060445	0.025451	0.095549
O	4.605928	4.871739	21.763396		-0.204300	0.088497	-0.059900
O	0.200681	1.553366	11.891411		0.060445	0.025451	-0.095549
O	-1.484267	2.167177	13.211906		0.204300	0.088497	0.059900
				60			
Au, (1.28 THz), intensity=0.0027							
H	2.636038	2.841927	1.306092		0.531502	0.102853	-0.008440
H	3.356104	4.417292	3.058800		0.563986	0.110671	-0.027664
H	2.033967	4.641224	5.132544		0.520919	0.227522	-0.066020
H	-0.015229	3.297549	5.438473		0.438206	0.349341	-0.092267
H	-0.732874	1.729957	3.670359		0.424366	0.316629	-0.057487
H	-0.766176	-0.109805	0.833090		0.463793	0.169709	0.027120
H	2.342432	5.546490	10.431063		-0.531502	0.102853	0.008440
H	1.622367	7.121854	8.678355		-0.563986	0.110671	0.027664
H	2.944504	7.345787	6.604612		-0.520919	0.227522	0.066020
H	4.993699	6.002111	6.298682		-0.438206	0.349341	0.092267
H	5.711345	4.434520	8.066796		-0.424366	0.316629	0.057487
H	5.744647	2.594757	10.904065		-0.463793	0.169709	-0.027120
H	1.414028	2.567198	22.050136		0.531502	0.102853	-0.008440
H	0.693962	0.991833	20.297429		0.563986	0.110671	-0.027664
H	2.016099	0.767901	18.223685		0.520919	0.227522	-0.066020
H	4.065294	2.111576	17.917755		0.438206	0.349341	-0.092267
H	4.782940	3.679168	19.685870		0.424366	0.316629	-0.057487
H	4.816242	5.518930	22.523138		0.463793	0.169709	0.027120
H	1.707633	-0.137365	12.925166		-0.531502	0.102853	0.008440
H	2.427699	-1.712729	14.677873		-0.563986	0.110671	0.027664
H	1.105562	-1.936662	16.751617		-0.520919	0.227522	0.066020
H	-0.943633	-0.592986	17.057547		-0.438206	0.349341	0.092267
H	-1.661279	0.974605	15.289433		-0.424366	0.316629	0.057487
H	-1.694581	2.814368	12.452164		-0.463793	0.169709	-0.027120
C	0.504476	1.247582	1.323252		0.459033	0.182640	-0.003586
C	0.911312	2.186038	2.385754		0.482850	0.198802	-0.024966
C	2.060337	2.946578	2.215307		0.517457	0.148268	-0.022391
C	2.461350	3.825160	3.199930		0.532787	0.156092	-0.035281
C	1.718447	3.949813	4.360759		0.510013	0.221861	-0.056045
C	0.570737	3.195965	4.533631		0.463251	0.288395	-0.069798
C	0.166542	2.317166	3.550619		0.454131	0.272327	-0.051575
C	4.473995	3.952145	10.413903		-0.459033	0.182640	0.003586
C	4.067158	4.890601	9.351401		-0.482850	0.198802	0.024966
C	2.918134	5.651140	9.521849		-0.517457	0.148268	0.022391
C	2.517120	6.529723	8.537225		-0.532787	0.156092	0.035281
C	3.260024	6.654376	7.376396		-0.510013	0.221861	0.056045
C	4.407733	5.900528	7.203525		-0.463251	0.288395	0.069798
C	4.811928	5.021729	8.186536		-0.454131	0.272327	0.051575
C	3.545590	4.161543	22.032977		0.459033	0.182640	-0.003586
C	3.138753	3.223087	20.970474		0.482850	0.198802	-0.024966
C	1.989729	2.462547	21.140922		0.517457	0.148268	-0.022391
C	1.588715	1.583965	20.156299		0.532787	0.156092	-0.035281
C	2.331619	1.459312	18.995470		0.510013	0.221861	-0.056045
C	3.479328	2.213160	18.822598		0.463251	0.288395	-0.069798
C	3.883524	3.091959	19.805609		0.454131	0.272327	-0.051575
C	-0.423929	1.456980	12.942325		-0.459033	0.182640	0.003586
C	-0.017093	0.518524	14.004828		-0.482850	0.198802	0.024966
C	1.131932	-0.242015	13.834380		-0.517457	0.148268	0.022391
C	1.532946	-1.120598	14.819003		-0.532787	0.156092	0.035281
C	0.790042	-1.245251	15.979833		-0.510013	0.221861	0.056045
C	-0.357667	-0.491403	16.152704		-0.463251	0.288395	0.069798
C	-0.761863	0.387396	15.169693		-0.454131	0.272327	0.051575
O	1.129086	1.151197	0.272338		0.400718	0.209868	-0.038196
O	-0.555862	0.537386	1.592833		0.499221	0.137607	0.043911
O	3.849385	3.855760	11.464817		-0.400718	0.209868	0.038196
O	5.534333	3.241948	10.144322		-0.499221	0.137607	-0.043911
O	2.920980	4.257928	23.083891		0.400718	0.209868	-0.038196
O	4.605928	4.871739	21.763396		0.499221	0.137607	0.043911
O	0.200681	1.553366	11.891411		-0.400718	0.209868	0.038196
O	-1.484267	2.167177	13.211906		-0.499221	0.137607	-0.043911
				60			
Bu, (1.31 THz), intensity=0.0024							
H	2.636038	2.841927	1.306092		0.262222	0.354296	-0.163948
H	3.356104	4.417292	3.058800		0.103524	0.536677	-0.261903
H	2.033967	4.641224	5.132544		-0.008923	0.651442	-0.344096
H	-0.015229	3.297549	5.438473		0.007903	0.618721	-0.353752
H	-0.732874	1.729957	3.670359		0.169774	0.443254	-0.250145
H	-0.766176	-0.109805	0.833090		0.386432	0.161633	-0.049846
H	2.342432	5.546490	10.431063		0.262222	-0.354296	-0.163948
H	1.622367	7.121854	8.678355		0.103524	-0.536677	-0.261903
H	2.944504	7.345787	6.604612		-0.008923	-0.651442	-0.344096
H	4.993699	6.002111	6.298682		0.007903	-0.618721	-0.353752
H	5.711345	4.434520	8.066796		0.169774	-0.443254	-0.250145
H	5.744647	2.594757	10.904065		0.386432	-0.161633	-0.049846
H	1.414028	2.567198	22.050136		0.262222	0.354296	-0.163948
H	0.693962	0.991833	20.297429		0.103524	0.536677	-0.261903
H	2.016099	0.767901	18.223685		-0.008923	0.651442	-0.344096
H	4.065294	2.111576	17.917755		0.007903	0.618721	-0.353752
H	4.782940	3.679168	19.685870		0.169774	0.443254	-0.250145
H	4.816242	5.518930	22.523138		0.386432	0.161633	-0.049846
H	1.707633	-0.137365	12.925166		0.262222	-0.354296	-0.163948
H	2.427699	-1.712729	14.677873		0.103524	-0.536677	-0.261903
H	1.105562	-1.936662	16.751617		-0.008923	-0.651442	-0.344096
H	-0.943633	-0.592986	17.057547		0.007903	-0.618721	-0.353752
H	-1.661279	0.974605	15.289433		0.169774	-0.443254	-0.250145
H	-1.694581	2.814368	12.452164		0.386432	-0.161633	-0.049846
C	0.504476	1.247582	1.323252		0.317600	0.248124	-0.117639
C	0.911312	2.186038	2.385754		0.230251	0.377328	-0.195775
C	2.060337	2.946578	2.215307		0.207490	0.411665	-0.204668
C	2.461350	3.825160	3.199930		0.117692	0.515716	-0.259557
C	1.718447	3.949813	4.360759		0.051880	0.584720	-0.307890
C	0.570737	3.195965	4.533631		0.065992	0.565258	-0.309445
C	0.166542	2.317166	3.550619		0.156012	0.463163	-0.253396
C	4.473995	3.952145	10.413903		0.317600	-0.248124	-0.117639
C	4.067158	4.890601	9.351401		0.230251	-0.377328	-0.195775
C	2.918134	5.651140	9.521849		0.207490	-0.411665	-0.204668
C	2.517120	6.529723	8.537225		0.117692	-0.515716	-0.259557
C	3.260024	6.654376	7.376396		0.051880	-0.584720	-0.307890
C	4.407733	5.900528	7.203525		0.065992	-0.565258	-0.309445
C	4.811928	5.021729	8.186536		0.156012	-0.463163	-0.253396
C	3.545590	4.161543	22.032977		0.317600	0.248124	-0.117639
C	3.138753	3.223087	20.970474		0.230251	0.377328	-0.195775
C	1.989729	2.462547	21.140922		0.207490	0.411665	-0.204668
C	1.588715	1.583965	20.156299		0.117692	0.515716	-0.259557
C	2.331619	1.459312	18.995470		0.051880	0.584720	-0.307890
C	3.479328	2.213160	18.822598		0.065992	0.565258	-0.309445
C	3.883524	3.091959	19.805609		0.156012	0.463163	-0.253396
C	-0.423929	1.456980	12.942325		0.317600	-0.248124	-0.117639
C	-0.017093	0.518524	14.004828		0.230251	-0.377328	-0.195775
C	1.131932	-0.242015	13.834380		0.207490	-0.411665	-0.204668
C	1.532946	-1.120598	14.819003		0.117692	-0.515716	-0.259557
C	0.790042	-1.245251	15.979833		0.051880	-0.584720	-0.307890
C	-0.357667	-0.491403	16.152704		0.065992	-0.565258	-0.309445
C	-0.761863	0.387396	15.169693		0.156012	-0.463163	-0.253396
O	1.129086	1.151197	0.272338		0.326486	0.206507	-0.107680
O	-0.555862	0.537386	1.592833		0.375887	0.178874	-0.063779
O	3.849385	3.855760	11.464817		0.326486	-0.206507	-0.107680
O	5.534333	3.241948	10.144322		0.375887	-0.178874	-0.063779
O	2.920980	4.257928	23.083891		0.326486	0.206507	-0.107680
O	4.605928	4.871739	21.763396		0.375887	0.178874	-0.063779
O	0.200681	1.553366	11.891411		0.326486	-0.206507	-0.107680
O	-1.484267	2.167177	13.211906		0.375887	-0.178874	-0.063779
				60			
Ag, (1.53 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.592468	-0.483640	-0.007202
H	3.356104	4.417292	3.058800		0.694723	-0.330716	-0.192898
H	2.033967	4.641224	5.132544		0.374258	0.456682	-0.485340
H	-0.015229	3.297549	5.438473		-0.052481	1.088426	-0.592781
H	-0.732874	1.729957	3.670359		-0.121064	0.875049	-0.374536
H	-0.766176	-0.109805	0.833090		0.058945	0.124175	0.071436
H	2.342432	5.546490	10.431063		-0.592468	-0.483640	0.007202
H	1.622367	7.121854	8.678355		-0.694723	-0.330716	0.192898
H	2.944504	7.345787	6.604612		-0.374258	0.456682	0.485340
H	4.993699	6.002111	6.298682		0.052481	1.088426	0.592781
H	5.711345	4.434520	8.066796		0.121064	0.875049	0.374536
H	5.744647	2.594757	10.904065		-0.058945	0.124175	-0.071436
H	1.414028	2.567198	22.050136		-0.592468	0.483640	0.007202
H	0.693962	0.991833	20.297429		-0.694723	0.330716	0.192898
H	2.016099	0.767901	18.223685		-0.374258	-0.456682	0.485340
H	4.065294	2.111576	17.917755		0.052481	-1.088426	0.592781
H	4.782940	3.679168	19.685870		0.121064	-0.875049	0.374536
H	4.816242	5.518930	22.523138		-0.058945	-0.124175	-0.071436
H	1.707633	-0.137365	12.925166		0.592468	0.483640	-0.007202
H	2.427699	-1.712729	14.677873		0.694723	0.330716	-0.192898
H	1.105562	-1.936662	16.751617		0.374258	-0.456682	-0.485340
H	-0.943633	-0.592986	17.057547		-0.052481	-1.088426	-0.592781
H	-1.661279	0.974605	15.289433		-0.121064	-0.875049	-0.374536
H	-1.694581	2.814368	12.452164		0.058945	-0.124175	0.071436
C	0.504476	1.247582	1.323252		0.156109	0.082581	-0.083132
C	0.911312	2.186038	2.385754		0.234033	0.166837	-0.178399
C	2.060337	2.946578	2.215307		0.458990	-0.161407	-0.129568
C	2.461350	3.825160	3.199930		0.516261	-0.069197	-0.233303
C	1.718447	3.949813	4.360759		0.338338	0.371398	-0.394206
C	0.570737	3.195965	4.533631		0.100187	0.721424	-0.453615
C	0.166542	2.317166	3.550619		0.059133	0.607554	-0.336678
C	4.473995	3.952145	10.413903		-0.156109	0.082581	0.083132
C	4.067158	4.890601	9.351401		-0.234033	0.166837	0.178399
C	2.918134	5.651140	9.521849		-0.458990	-0.161407	0.129568
C	2.517120	6.529723	8.537225		-0.516261	-0.069197	0.233303
C	3.260024	6.654376	7.376396		-0.338338	0.371398	0.394206
C	4.407733	5.900528	7.203525		-0.100187	0.721424	0.453615
C	4.811928	5.021729	8.186536		-0.059133	0.607554	0.336678
C	3.545590	4.161543	22.032977		-0.156109	-0.082581	0.083132
C	3.138753	3.223087	20.970474		-0.234033	-0.166837	0.178399
C	1.989729	2.462547	21.140922		-0.458990	0.161407	0.129568
C	1.588715	1.583965	20.156299		-0.516261	0.069197	0.233303
C	2.331619	1.459312	18.995470		-0.338338	-0.371398	0.394206
C	3.479328	2.213160	18.822598		-0.100187	-0.721424	0.453615
C	3.883524	3.091959	19.805609		-0.059133	-0.607554	0.336678
C	-0.423929	1.456980	12.942325		0.156109	-0.082581	-0.083132
C	-0.017093	0.518524	14.004828		0.234033	-0.166837	-0.178399
C	1.131932	-0.242015	13.834380		0.458990	0.161407	-0.129568
C	1.532946	-1.120598	14.819003		0.516261	0.069197	-0.233303
C	0.790042	-1.245251	15.979833		0.338338	-0.371398	-0.394206
C	-0.357667	-0.491403	16.152704		0.100187	-0.721424	-0.453615
C	-0.761863	0.387396	15.169693		0.059133	-0.607554	-0.336678
O	1.129086	1.151197	0.272338		0.087476	-0.027907	-0.110876
O	-0.555862	0.537386	1.592833		0.140232	0.137041	0.025439
O	3.849385	3.855760	11.464817		-0.087476	-0.027907	0.110876
O	5.534333	3.241948	10.144322		-0.140232	0.137041	-0.025439
O	2.920980	4.257928	23.083891		-0.087476	0.027907	0.110876
O	4.605928	4.871739	21.763396		-0.140232	-0.137041	-0.025439
O	0.200681	1.553366	11.891411		0.087476	0.027907	-0.110876
O	-1.484267	2.167177	13.211906		0.140232	-0.137041	0.025439
				60			
Bg, (1.71 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.362729	-0.134698	-0.179540
H	3.356104	4.417292	3.058800		0.395162	0.049392	-0.370335
H	2.033967	4.641224	5.132544		0.208051	0.590134	-0.547432
H	-0.015229	3.297549	5.438473		-0.045159	0.962136	-0.563443
H	-0.732874	1.729957	3.670359		-0.074432	0.776326	-0.363220
H	-0.766176	-0.109805	0.833090		0.066852	0.123647	0.064359
H	2.342432	5.546490	10.431063		0.362729	0.134698	-0.179540
H	1.622367	7.121854	8.678355		0.395162	-0.049392	-0.370335
H	2.944504	7.345787	6.604612		0.208051	-0.590134	-0.547432
H	4.993699	6.002111	6.298682		-0.045159	-0.962136	-0.563443
H	5.711345	4.434520	8.066796		-0.074432	-0.776326	-0.363220
H	5.744647	2.594757	10.904065		0.066852	-0.123647	0.064359
H	1.414028	2.567198	22.050136		-0.362729	0.134698	0.179540
H	0.693962	0.991833	20.297429		-0.395162	-0.049392	0.370335
H	2.016099	0.767901	18.223685		-0.208051	-0.590134	0.547432
H	4.065294	2.111576	17.917755		0.045159	-0.962136	0.563443
H	4.782940	3.679168	19.685870		0.074432	-0.776326	0.363220
H	4.816242	5.518930	22.523138		-0.066852	-0.123647	-0.064359
H	1.707633	-0.137365	12.925166		-0.362729	-0.134698	0.179540
H	2.427699	-1.712729	14.677873		-0.395162	0.049392	0.370335
H	1.105562	-1.936662	16.751617		-0.208051	0.590134	0.547432
H	-0.943633	-0.592986	17.057547		0.045159	0.962136	0.563443
H	-1.661279	0.974605	15.289433		0.074432	0.776326	0.363220
H	-1.694581	2.814368	12.452164		-0.066852	0.123647	-0.064359
C	0.504476	1.247582	1.323252		0.111644	0.155171	-0.136946
C	0.911312	2.186038	2.385754		0.143484	0.289329	-0.260223
C	2.060337	2.946578	2.215307		0.271284	0.097013	-0.264860
C	2.461350	3.825160	3.199930		0.292328	0.206388	-0.368707
C	1.718447	3.949813	4.360759		0.185229	0.515099	-0.469665
C	0.570737	3.195965	4.533631		0.046876	0.726888	-0.476406
C	0.166542	2.317166	3.550619		0.030893	0.613656	-0.367473
C	4.473995	3.952145	10.413903		0.111644	-0.155171	-0.136946
C	4.067158	4.890601	9.351401		0.143484	-0.289329	-0.260223
C	2.918134	5.651140	9.521849		0.271284	-0.097013	-0.264860
C	2.517120	6.529723	8.537225		0.292328	-0.206388	-0.368707
C	3.260024	6.654376	7.376396		0.185229	-0.515099	-0.469665
C	4.407733	5.900528	7.203525		0.046876	-0.726888	-0.476406
C	4.811928	5.021729	8.186536		0.030893	-0.613656	-0.367473
C	3.545590	4.161543	22.032977		-0.111644	-0.155171	0.136946
C	3.138753	3.223087	20.970474		-0.143484	-0.289329	0.260223
C	1.989729	2.462547	21.140922		-0.271284	-0.097013	0.264860
C	1.588715	1.583965	20.156299		-0.292328	-0.206388	0.368707
C	2.331619	1.459312	18.995470		-0.185229	-0.515099	0.469665
C	3.479328	2.213160	18.822598		-0.046876	-0.726888	0.476406
C	3.883524	3.091959	19.805609		-0.030893	-0.613656	0.367473
C	-0.423929	1.456980	12.942325		-0.111644	0.155171	0.136946
C	-0.017093	0.518524	14.004828		-0.143484	0.289329	0.260223
C	1.131932	-0.242015	13.834380		-0.271284	0.097013	0.264860
C	1.532946	-1.120598	14.819003		-0.292328	0.206388	0.368707
C	0.790042	-1.245251	15.979833		-0.185229	0.515099	0.469665
C	-0.357667	-0.491403	16.152704		-0.046876	0.726888	0.476406
C	-0.761863	0.387396	15.169693		-0.030893	0.613656	0.367473
O	1.129086	1.151197	0.272338		0.059988	0.021735	-0.153352
O	-0.555862	0.537386	1.592833		0.120598	0.179863	-0.009678
O	3.849385	3.855760	11.464817		0.059988	-0.021735	-0.153352
O	5.534333	3.241948	10.144322		0.120598	-0.179863	-0.009678
O	2.920980	4.257928	23.083891		-0.059988	-0.021735	0.153352
O	4.605928	4.871739	21.763396		-0.120598	-0.179863	0.009678
O	0.200681	1.553366	11.891411		-0.059988	0.021735	0.153352
O	-1.484267	2.167177	13.211906		-0.120598	0.179863	0.009678
				60			
Au, (1.87 THz), intensity=0.0010							
H	2.636038	2.841927	1.306092		-0.601451	1.122657	-0.408608
H	3.356104	4.417292	3.058800		-0.727597	1.092536	-0.335690
H	2.033967	4.641224	5.132544		-0.131202	0.071014	0.159689
H	-0.015229	3.297549	5.438473		0.556518	-0.895478	0.558016
H	-0.732874	1.729957	3.670359		0.610911	-0.767407	0.428950
H	-0.766176	-0.109805	0.833090		0.093588	0.139009	-0.012080
H	2.342432	5.546490	10.431063		0.601451	1.122657	0.408608
H	1.622367	7.121854	8.678355		0.727597	1.092536	0.335690
H	2.944504	7.345787	6.604612		0.131202	0.071014	-0.159689
H	4.993699	6.002111	6.298682		-0.556518	-0.895478	-0.558016
H	5.711345	4.434520	8.066796		-0.610911	-0.767407	-0.428950
H	5.744647	2.594757	10.904065		-0.093588	0.139009	0.012080
H	1.414028	2.567198	22.050136		-0.601451	1.122657	-0.408608
H	0.693962	0.991833	20.297429		-0.727597	1.092536	-0.335690
H	2.016099	0.767901	18.223685		-0.131202	0.071014	0.159689
H	4.065294	2.111576	17.917755		0.556518	-0.895478	0.558016
H	4.782940	3.679168	19.685870		0.610911	-0.767407	0.428950
H	4.816242	5.518930	22.523138		0.093588	0.139009	-0.012080
H	1.707633	-0.137365	12.925166		0.601451	1.122657	0.408608
H	2.427699	-1.712729	14.677873		0.727597	1.092536	0.335690
H	1.105562	-1.936662	16.751617		0.131202	0.071014	-0.159689
H	-0.943633	-0.592986	17.057547		-0.556518	-0.895478	-0.558016
H	-1.661279	0.974605	15.289433		-0.610911	-0.767407	-0.428950
H	-1.694581	2.814368	12.452164		-0.093588	0.139009	0.012080
C	0.504476	1.247582	1.323252		0.041592	0.193282	-0.022371
C	0.911312	2.186038	2.385754		-0.004121	0.198001	-0.007022
C	2.060337	2.946578	2.215307		-0.374239	0.712461	-0.216255
C	2.461350	3.825160	3.199930		-0.434606	0.688636	-0.168446
C	1.718447	3.949813	4.360759		-0.100176	0.115773	0.107281
C	0.570737	3.195965	4.533631		0.283508	-0.418329	0.328121
C	0.166542	2.317166	3.550619		0.318355	-0.355462	0.260529
C	4.473995	3.952145	10.413903		-0.041592	0.193282	0.022371
C	4.067158	4.890601	9.351401		0.004121	0.198001	0.007022
C	2.918134	5.651140	9.521849		0.374239	0.712461	0.216255
C	2.517120	6.529723	8.537225		0.434606	0.688636	0.168446
C	3.260024	6.654376	7.376396		0.100176	0.115773	-0.107281
C	4.407733	5.900528	7.203525		-0.283508	-0.418329	-0.328121
C	4.811928	5.021729	8.186536		-0.318355	-0.355462	-0.260529
C	3.545590	4.161543	22.032977		0.041592	0.193282	-0.022371
C	3.138753	3.223087	20.970474		-0.004121	0.198001	-0.007022
C	1.989729	2.462547	21.140922		-0.374239	0.712461	-0.216255
C	1.588715	1.583965	20.156299		-0.434606	0.688636	-0.168446
C	2.331619	1.459312	18.995470		-0.100176	0.115773	0.107281
C	3.479328	2.213160	18.822598		0.283508	-0.418329	0.328121
C	3.883524	3.091959	19.805609		0.318355	-0.355462	0.260529
C	-0.423929	1.456980	12.942325		-0.041592	0.193282	0.022371
C	-0.017093	0.518524	14.004828		0.004121	0.198001	0.007022
C	1.131932	-0.242015	13.834380		0.374239	0.712461	0.216255
C	1.532946	-1.120598	14.819003		0.434606	0.688636	0.168446
C	0.790042	-1.245251	15.979833		0.100176	0.115773	-0.107281
C	-0.357667	-0.491403	16.152704		-0.283508	-0.418329	-0.328121
C	-0.761863	0.387396	15.169693		-0.318355	-0.355462	-0.260529
O	1.129086	1.151197	0.272338		0.008225	0.247608	-0.049482
O	-0.555862	0.537386	1.592833		0.110089	0.106271	0.009987
O	3.849385	3.855760	11.464817		-0.008225	0.247608	0.049482
O	5.534333	3.241948	10.144322		-0.110089	0.106271	-0.009987
O	2.920980	4.257928	23.083891		0.008225	0.247608	-0.049482
O	4.605928	4.871739	21.763396		0.110089	0.106271	0.009987
O	0.200681	1.553366	11.891411		-0.008225	0.247608	0.049482
O	-1.484267	2.167177	13.211906		-0.110089	0.106271	-0.009987
				60			
Ag, (1.91 THz), IR inactive						
H	2.636038	2.841927	1.306092		-0.417307	0.938702	-0.644405
H	3.356104	4.417292	3.058800		-0.463061	1.034842	-0.736781
H	2.033967	4.641224	5.132544		0.104112	0.355137	-0.297375
H	-0.015229	3.297549	5.438473		0.689699	-0.425910	0.213266
H	-0.732874	1.729957	3.670359		0.694804	-0.490862	0.277899
H	-0.766176	-0.109805	0.833090		0.189375	-0.040446	0.111701
H	2.342432	5.546490	10.431063		0.417307	0.938702	0.644405
H	1.622367	7.121854	8.678355		0.463061	1.034842	0.736781
H	2.944504	7.345787	6.604612		-0.104112	0.355137	0.297375
H	4.993699	6.002111	6.298682		-0.689699	-0.425910	-0.213266
H	5.711345	4.434520	8.066796		-0.694804	-0.490862	-0.277899
H	5.744647	2.594757	10.904065		-0.189375	-0.040446	-0.111701
H	1.414028	2.567198	22.050136		0.417307	-0.938702	0.644405
H	0.693962	0.991833	20.297429		0.463061	-1.034842	0.736781
H	2.016099	0.767901	18.223685		-0.104112	-0.355137	0.297375
H	4.065294	2.111576	17.917755		-0.689699	0.425910	-0.213266
H	4.782940	3.679168	19.685870		-0.694804	0.490862	-0.277899
H	4.816242	5.518930	22.523138		-0.189375	0.040446	-0.111701
H	1.707633	-0.137365	12.925166		-0.417307	-0.938702	-0.644405
H	2.427699	-1.712729	14.677873		-0.463061	-1.034842	-0.736781
H	1.105562	-1.936662	16.751617		0.104112	-0.355137	-0.297375
H	-0.943633	-0.592986	17.057547		0.689699	0.425910	0.213266
H	-1.661279	0.974605	15.289433		0.694804	0.490862	0.277899
H	-1.694581	2.814368	12.452164		0.189375	0.040446	0.111701
C	0.504476	1.247582	1.323252		0.124671	0.120998	-0.112003
C	0.911312	2.186038	2.385754		0.131722	0.210957	-0.188375
C	2.060337	2.946578	2.215307		-0.192779	0.641903	-0.468662
C	2.461350	3.825160	3.199930		-0.209080	0.704130	-0.515072
C	1.718447	3.949813	4.360759		0.111141	0.321142	-0.269286
C	0.570737	3.195965	4.533631		0.438022	-0.111187	0.014863
C	0.166542	2.317166	3.550619		0.443024	-0.152801	0.051844
C	4.473995	3.952145	10.413903		-0.124671	0.120998	0.112003
C	4.067158	4.890601	9.351401		-0.131722	0.210957	0.188375
C	2.918134	5.651140	9.521849		0.192779	0.641903	0.468662
C	2.517120	6.529723	8.537225		0.209080	0.704130	0.515072
C	3.260024	6.654376	7.376396		-0.111141	0.321142	0.269286
C	4.407733	5.900528	7.203525		-0.438022	-0.111187	-0.014863
C	4.811928	5.021729	8.186536		-0.443024	-0.152801	-0.051844
C	3.545590	4.161543	22.032977		-0.124671	-0.120998	0.112003
C	3.138753	3.223087	20.970474		-0.131722	-0.210957	0.188375
C	1.989729	2.462547	21.140922		0.192779	-0.641903	0.468662
C	1.588715	1.583965	20.156299		0.209080	-0.704130	0.515072
C	2.331619	1.459312	18.995470		-0.111141	-0.321142	0.269286
C	3.479328	2.213160	18.822598		-0.438022	0.111187	-0.014863
C	3.883524	3.091959	19.805609		-0.443024	0.152801	-0.051844
C	-0.423929	1.456980	12.942325		0.124671	-0.120998	-0.112003
C	-0.017093	0.518524	14.004828		0.131722	-0.210957	-0.188375
C	1.131932	-0.242015	13.834380		-0.192779	-0.641903	-0.468662
C	1.532946	-1.120598	14.819003		-0.209080	-0.704130	-0.515072
C	0.790042	-1.245251	15.979833		0.111141	-0.321142	-0.269286
C	-0.357667	-0.491403	16.152704		0.438022	0.111187	0.014863
C	-0.761863	0.387396	15.169693		0.443024	0.152801	0.051844
O	1.129086	1.151197	0.272338		-0.000130	0.130693	-0.186945
O	-0.555862	0.537386	1.592833		0.235412	0.009564	0.047394
O	3.849385	3.855760	11.464817		0.000130	0.130693	0.186945
O	5.534333	3.241948	10.144322		-0.235412	0.009564	-0.047394
O	2.920980	4.257928	23.083891		0.000130	-0.130693	0.186945
O	4.605928	4.871739	21.763396		-0.235412	-0.009564	-0.047394
O	0.200681	1.553366	11.891411		-0.000130	-0.130693	-0.186945
O	-1.484267	2.167177	13.211906		0.235412	-0.009564	0.047394
				60			
Bg, (1.98 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.563742	-1.026856	0.625279
H	3.356104	4.417292	3.058800		0.609133	-1.068510	0.663785
H	2.033967	4.641224	5.132544		-0.045996	-0.202811	0.153578
H	-0.015229	3.297549	5.438473		-0.706055	0.675781	-0.375682
H	-0.732874	1.729957	3.670359		-0.721712	0.716527	-0.392925
H	-0.766176	-0.109805	0.833090		-0.171962	0.076504	-0.096966
H	2.342432	5.546490	10.431063		0.563742	1.026856	0.625279
H	1.622367	7.121854	8.678355		0.609133	1.068510	0.663785
H	2.944504	7.345787	6.604612		-0.045996	0.202811	0.153578
H	4.993699	6.002111	6.298682		-0.706055	-0.675781	-0.375682
H	5.711345	4.434520	8.066796		-0.721712	-0.716527	-0.392925
H	5.744647	2.594757	10.904065		-0.171962	-0.076504	-0.096966
H	1.414028	2.567198	22.050136		-0.563742	1.026856	-0.625279
H	0.693962	0.991833	20.297429		-0.609133	1.068510	-0.663785
H	2.016099	0.767901	18.223685		0.045996	0.202811	-0.153578
H	4.065294	2.111576	17.917755		0.706055	-0.675781	0.375682
H	4.782940	3.679168	19.685870		0.721712	-0.716527	0.392925
H	4.816242	5.518930	22.523138		0.171962	-0.076504	0.096966
H	1.707633	-0.137365	12.925166		-0.563742	-1.026856	-0.625279
H	2.427699	-1.712729	14.677873		-0.609133	-1.068510	-0.663785
H	1.105562	-1.936662	16.751617		0.045996	-0.202811	-0.153578
H	-0.943633	-0.592986	17.057547		0.706055	0.675781	0.375682
H	-1.661279	0.974605	15.289433		0.721712	0.716527	0.392925
H	-1.694581	2.814368	12.452164		0.171962	0.076504	0.096966
C	0.504476	1.247582	1.323252		-0.081896	-0.088089	0.076243
C	0.911312	2.186038	2.385754		-0.075096	-0.147678	0.121692
C	2.060337	2.946578	2.215307		0.300359	-0.651907	0.415787
C	2.461350	3.825160	3.199930		0.317387	-0.682364	0.434170
C	1.718447	3.949813	4.360759		-0.049924	-0.194787	0.147788
C	0.570737	3.195965	4.533631		-0.423576	0.306943	-0.150491
C	0.166542	2.317166	3.550619		-0.431461	0.320209	-0.159338
C	4.473995	3.952145	10.413903		-0.081896	0.088089	0.076243
C	4.067158	4.890601	9.351401		-0.075096	0.147678	0.121692
C	2.918134	5.651140	9.521849		0.300359	0.651907	0.415787
C	2.517120	6.529723	8.537225		0.317387	0.682364	0.434170
C	3.260024	6.654376	7.376396		-0.049924	0.194787	0.147788
C	4.407733	5.900528	7.203525		-0.423576	-0.306943	-0.150491
C	4.811928	5.021729	8.186536		-0.431461	-0.320209	-0.159338
C	3.545590	4.161543	22.032977		0.081896	0.088089	-0.076243
C	3.138753	3.223087	20.970474		0.075096	0.147678	-0.121692
C	1.989729	2.462547	21.140922		-0.300359	0.651907	-0.415787
C	1.588715	1.583965	20.156299		-0.317387	0.682364	-0.434170
C	2.331619	1.459312	18.995470		0.049924	0.194787	-0.147788
C	3.479328	2.213160	18.822598		0.423576	-0.306943	0.150491
C	3.883524	3.091959	19.805609		0.431461	-0.320209	0.159338
C	-0.423929	1.456980	12.942325		0.081896	-0.088089	-0.076243
C	-0.017093	0.518524	14.004828		0.075096	-0.147678	-0.121692
C	1.131932	-0.242015	13.834380		-0.300359	-0.651907	-0.415787
C	1.532946	-1.120598	14.819003		-0.317387	-0.682364	-0.434170
C	0.790042	-1.245251	15.979833		0.049924	-0.194787	-0.147788
C	-0.357667	-0.491403	16.152704		0.423576	0.306943	0.150491
C	-0.761863	0.387396	15.169693		0.431461	0.320209	0.159338
O	1.129086	1.151197	0.272338		0.027638	-0.134243	0.145989
O	-0.555862	0.537386	1.592833		-0.195697	0.037505	-0.050530
O	3.849385	3.855760	11.464817		0.027638	0.134243	0.145989
O	5.534333	3.241948	10.144322		-0.195697	-0.037505	-0.050530
O	2.920980	4.257928	23.083891		-0.027638	0.134243	-0.145989
O	4.605928	4.871739	21.763396		0.195697	-0.037505	0.050530
O	0.200681	1.553366	11.891411		-0.027638	-0.134243	-0.145989
O	-1.484267	2.167177	13.211906		0.195697	0.037505	0.050530
				60			
Bu, (2.04 THz), intensity=0.0005							
H	2.636038	2.841927	1.306092		0.651350	-1.031760	0.462913
H	3.356104	4.417292	3.058800		0.740406	-1.021966	0.420876
H	2.033967	4.641224	5.132544		0.082882	-0.001172	-0.106522
H	-0.015229	3.297549	5.438473		-0.632692	0.970916	-0.584532
H	-0.732874	1.729957	3.670359		-0.671802	0.921085	-0.502940
H	-0.766176	-0.109805	0.833090		-0.068091	-0.036624	-0.002959
H	2.342432	5.546490	10.431063		0.651350	1.031760	0.462913
H	1.622367	7.121854	8.678355		0.740406	1.021966	0.420876
H	2.944504	7.345787	6.604612		0.082882	0.001172	-0.106522
H	4.993699	6.002111	6.298682		-0.632692	-0.970916	-0.584532
H	5.711345	4.434520	8.066796		-0.671802	-0.921085	-0.502940
H	5.744647	2.594757	10.904065		-0.068091	0.036624	-0.002959
H	1.414028	2.567198	22.050136		0.651350	-1.031760	0.462913
H	0.693962	0.991833	20.297429		0.740406	-1.021966	0.420876
H	2.016099	0.767901	18.223685		0.082882	-0.001172	-0.106522
H	4.065294	2.111576	17.917755		-0.632692	0.970916	-0.584532
H	4.782940	3.679168	19.685870		-0.671802	0.921085	-0.502940
H	4.816242	5.518930	22.523138		-0.068091	-0.036624	-0.002959
H	1.707633	-0.137365	12.925166		0.651350	1.031760	0.462913
H	2.427699	-1.712729	14.677873		0.740406	1.021966	0.420876
H	1.105562	-1.936662	16.751617		0.082882	0.001172	-0.106522
H	-0.943633	-0.592986	17.057547		-0.632692	-0.970916	-0.584532
H	-1.661279	0.974605	15.289433		-0.671802	-0.921085	-0.502940
H	-1.694581	2.814368	12.452164		-0.068091	0.036624	-0.002959
C	0.504476	1.247582	1.323252		-0.024949	-0.080496	0.008353
C	0.911312	2.186038	2.385754		-0.002277	-0.074684	-0.006891
C	2.060337	2.946578	2.215307		0.389830	-0.611760	0.247857
C	2.461350	3.825160	3.199930		0.430263	-0.600499	0.220013
C	1.718447	3.949813	4.360759		0.061246	-0.023969	-0.077135
C	0.570737	3.195965	4.533631		-0.341549	0.529650	-0.345384
C	0.166542	2.317166	3.550619		-0.363731	0.490746	-0.301786
C	4.473995	3.952145	10.413903		-0.024949	0.080496	0.008353
C	4.067158	4.890601	9.351401		-0.002277	0.074684	-0.006891
C	2.918134	5.651140	9.521849		0.389830	0.611760	0.247857
C	2.517120	6.529723	8.537225		0.430263	0.600499	0.220013
C	3.260024	6.654376	7.376396		0.061246	0.023969	-0.077135
C	4.407733	5.900528	7.203525		-0.341549	-0.529650	-0.345384
C	4.811928	5.021729	8.186536		-0.363731	-0.490746	-0.301786
C	3.545590	4.161543	22.032977		-0.024949	-0.080496	0.008353
C	3.138753	3.223087	20.970474		-0.002277	-0.074684	-0.006891
C	1.989729	2.462547	21.140922		0.389830	-0.611760	0.247857
C	1.588715	1.583965	20.156299		0.430263	-0.600499	0.220013
C	2.331619	1.459312	18.995470		0.061246	-0.023969	-0.077135
C	3.479328	2.213160	18.822598		-0.341549	0.529650	-0.345384
C	3.883524	3.091959	19.805609		-0.363731	0.490746	-0.301786
C	-0.423929	1.456980	12.942325		-0.024949	0.080496	0.008353
C	-0.017093	0.518524	14.004828		-0.002277	0.074684	-0.006891
C	1.131932	-0.242015	13.834380		0.389830	0.611760	0.247857
C	1.532946	-1.120598	14.819003		0.430263	0.600499	0.220013
C	0.790042	-1.245251	15.979833		0.061246	0.023969	-0.077135
C	-0.357667	-0.491403	16.152704		-0.341549	-0.529650	-0.345384
C	-0.761863	0.387396	15.169693		-0.363731	-0.490746	-0.301786
O	1.129086	1.151197	0.272338		0.028939	-0.153751	0.049653
O	-0.555862	0.537386	1.592833		-0.097918	0.009477	-0.032017
O	3.849385	3.855760	11.464817		0.028939	0.153751	0.049653
O	5.534333	3.241948	10.144322		-0.097918	-0.009477	-0.032017
O	2.920980	4.257928	23.083891		0.028939	-0.153751	0.049653
O	4.605928	4.871739	21.763396		-0.097918	0.009477	-0.032017
O	0.200681	1.553366	11.891411		0.028939	0.153751	0.049653
O	-1.484267	2.167177	13.211906		-0.097918	-0.009477	-0.032017
				60			
Au, (2.15 THz), intensity=0.0061							
H	2.636038	2.841927	1.306092		0.114536	0.030588	0.611734
H	3.356104	4.417292	3.058800		0.135413	-0.142311	0.757098
H	2.033967	4.641224	5.132544		0.053390	-0.195171	0.710001
H	-0.015229	3.297549	5.438473		-0.073026	-0.060251	0.502054
H	-0.732874	1.729957	3.670359		-0.102970	0.132977	0.347116
H	-0.766176	-0.109805	0.833090		-0.018820	0.187650	0.343205
H	2.342432	5.546490	10.431063		-0.114536	0.030588	-0.611734
H	1.622367	7.121854	8.678355		-0.135413	-0.142311	-0.757098
H	2.944504	7.345787	6.604612		-0.053390	-0.195171	-0.710001
H	4.993699	6.002111	6.298682		0.073026	-0.060251	-0.502054
H	5.711345	4.434520	8.066796		0.102970	0.132977	-0.347116
H	5.744647	2.594757	10.904065		0.018820	0.187650	-0.343205
H	1.414028	2.567198	22.050136		0.114536	0.030588	0.611734
H	0.693962	0.991833	20.297429		0.135413	-0.142311	0.757098
H	2.016099	0.767901	18.223685		0.053390	-0.195171	0.710001
H	4.065294	2.111576	17.917755		-0.073026	-0.060251	0.502054
H	4.782940	3.679168	19.685870		-0.102970	0.132977	0.347116
H	4.816242	5.518930	22.523138		-0.018820	0.187650	0.343205
H	1.707633	-0.137365	12.925166		-0.114536	0.030588	-0.611734
H	2.427699	-1.712729	14.677873		-0.135413	-0.142311	-0.757098
H	1.105562	-1.936662	16.751617		-0.053390	-0.195171	-0.710001
H	-0.943633	-0.592986	17.057547		0.073026	-0.060251	-0.502054
H	-1.661279	0.974605	15.289433		0.102970	0.132977	-0.347116
H	-1.694581	2.814368	12.452164		0.018820	0.187650	-0.343205
C	0.504476	1.247582	1.323252		0.003623	0.153138	0.409470
C	0.911312	2.186038	2.385754		0.003019	0.091381	0.469668
C	2.060337	2.946578	2.215307		0.068947	0.016635	0.584549
C	2.461350	3.825160	3.199930		0.081593	-0.082606	0.668436
C	1.718447	3.949813	4.360759		0.033878	-0.108774	0.640793
C	0.570737	3.195965	4.533631		-0.034604	-0.032737	0.524626
C	0.166542	2.317166	3.550619		-0.051559	0.072426	0.437975
C	4.473995	3.952145	10.413903		-0.003623	0.153138	-0.409470
C	4.067158	4.890601	9.351401		-0.003019	0.091381	-0.469668
C	2.918134	5.651140	9.521849		-0.068947	0.016635	-0.584549
C	2.517120	6.529723	8.537225		-0.081593	-0.082606	-0.668436
C	3.260024	6.654376	7.376396		-0.033878	-0.108774	-0.640793
C	4.407733	5.900528	7.203525		0.034604	-0.032737	-0.524626
C	4.811928	5.021729	8.186536		0.051559	0.072426	-0.437975
C	3.545590	4.161543	22.032977		0.003623	0.153138	0.409470
C	3.138753	3.223087	20.970474		0.003019	0.091381	0.469668
C	1.989729	2.462547	21.140922		0.068947	0.016635	0.584549
C	1.588715	1.583965	20.156299		0.081593	-0.082606	0.668436
C	2.331619	1.459312	18.995470		0.033878	-0.108774	0.640793
C	3.479328	2.213160	18.822598		-0.034604	-0.032737	0.524626
C	3.883524	3.091959	19.805609		-0.051559	0.072426	0.437975
C	-0.423929	1.456980	12.942325		-0.003623	0.153138	-0.409470
C	-0.017093	0.518524	14.004828		-0.003019	0.091381	-0.469668
C	1.131932	-0.242015	13.834380		-0.068947	0.016635	-0.584549
C	1.532946	-1.120598	14.819003		-0.081593	-0.082606	-0.668436
C	0.790042	-1.245251	15.979833		-0.033878	-0.108774	-0.640793
C	-0.357667	-0.491403	16.152704		0.034604	-0.032737	-0.524626
C	-0.761863	0.387396	15.169693		0.051559	0.072426	-0.437975
O	1.129086	1.151197	0.272338		0.050783	0.135033	0.439028
O	-0.555862	0.537386	1.592833		-0.049652	0.209437	0.335342
O	3.849385	3.855760	11.464817		-0.050783	0.135033	-0.439028
O	5.534333	3.241948	10.144322		0.049652	0.209437	-0.335342
O	2.920980	4.257928	23.083891		0.050783	0.135033	0.439028
O	4.605928	4.871739	21.763396		-0.049652	0.209437	0.335342
O	0.200681	1.553366	11.891411		-0.050783	0.135033	-0.439028
O	-1.484267	2.167177	13.211906		0.049652	0.209437	-0.335342
				60			
Au, (2.37 THz), intensity=0.0021							
H	2.636038	2.841927	1.306092		0.243362	-0.059376	0.283257
H	3.356104	4.417292	3.058800		-0.380290	0.337172	0.187509
H	2.033967	4.641224	5.132544		-0.777890	0.368183	-0.073958
H	-0.015229	3.297549	5.438473		-0.494421	-0.094215	-0.176451
H	-0.732874	1.729957	3.670359		0.149295	-0.511052	-0.065509
H	-0.766176	-0.109805	0.833090		0.577847	-0.564115	0.150334
H	2.342432	5.546490	10.431063		-0.243362	-0.059376	-0.283257
H	1.622367	7.121854	8.678355		0.380290	0.337172	-0.187509
H	2.944504	7.345787	6.604612		0.777890	0.368183	0.073958
H	4.993699	6.002111	6.298682		0.494421	-0.094215	0.176451
H	5.711345	4.434520	8.066796		-0.149295	-0.511052	0.065509
H	5.744647	2.594757	10.904065		-0.577847	-0.564115	-0.150334
H	1.414028	2.567198	22.050136		0.243362	-0.059376	0.283257
H	0.693962	0.991833	20.297429		-0.380290	0.337172	0.187509
H	2.016099	0.767901	18.223685		-0.777890	0.368183	-0.073958
H	4.065294	2.111576	17.917755		-0.494421	-0.094215	-0.176451
H	4.782940	3.679168	19.685870		0.149295	-0.511052	-0.065509
H	4.816242	5.518930	22.523138		0.577847	-0.564115	0.150334
H	1.707633	-0.137365	12.925166		-0.243362	-0.059376	-0.283257
H	2.427699	-1.712729	14.677873		0.380290	0.337172	-0.187509
H	1.105562	-1.936662	16.751617		0.777890	0.368183	0.073958
H	-0.943633	-0.592986	17.057547		0.494421	-0.094215	0.176451
H	-1.661279	0.974605	15.289433		-0.149295	-0.511052	0.065509
H	-1.694581	2.814368	12.452164		-0.577847	-0.564115	-0.150334
C	0.504476	1.247582	1.323252		0.447774	-0.424002	0.137499
C	0.911312	2.186038	2.385754		0.226224	-0.298933	0.113012
C	2.060337	2.946578	2.215307		0.086661	-0.075090	0.187522
C	2.461350	3.825160	3.199930		-0.269548	0.154875	0.131055
C	1.718447	3.949813	4.360759		-0.488945	0.164307	-0.009412
C	0.570737	3.195965	4.533631		-0.327244	-0.091552	-0.068061
C	0.166542	2.317166	3.550619		0.034990	-0.325266	-0.004437
C	4.473995	3.952145	10.413903		-0.447774	-0.424002	-0.137499
C	4.067158	4.890601	9.351401		-0.226224	-0.298933	-0.113012
C	2.918134	5.651140	9.521849		-0.086661	-0.075090	-0.187522
C	2.517120	6.529723	8.537225		0.269548	0.154875	-0.131055
C	3.260024	6.654376	7.376396		0.488945	0.164307	0.009412
C	4.407733	5.900528	7.203525		0.327244	-0.091552	0.068061
C	4.811928	5.021729	8.186536		-0.034990	-0.325266	0.004437
C	3.545590	4.161543	22.032977		0.447774	-0.424002	0.137499
C	3.138753	3.223087	20.970474		0.226224	-0.298933	0.113012
C	1.989729	2.462547	21.140922		0.086661	-0.075090	0.187522
C	1.588715	1.583965	20.156299		-0.269548	0.154875	0.131055
C	2.331619	1.459312	18.995470		-0.488945	0.164307	-0.009412
C	3.479328	2.213160	18.822598		-0.327244	-0.091552	-0.068061
C	3.883524	3.091959	19.805609		0.034990	-0.325266	-0.004437
C	-0.423929	1.456980	12.942325		-0.447774	-0.424002	-0.137499
C	-0.017093	0.518524	14.004828		-0.226224	-0.298933	-0.113012
C	1.131932	-0.242015	13.834380		-0.086661	-0.075090	-0.187522
C	1.532946	-1.120598	14.819003		0.269548	0.154875	-0.131055
C	0.790042	-1.245251	15.979833		0.488945	0.164307	0.009412
C	-0.357667	-0.491403	16.152704		0.327244	-0.091552	0.068061
C	-0.761863	0.387396	15.169693		-0.034990	-0.325266	0.004437
O	1.129086	1.151197	0.272338		0.426586	-0.324595	0.114809
O	-0.555862	0.537386	1.592833		0.587545	-0.601657	0.187130
O	3.849385	3.855760	11.464817		-0.426586	-0.324595	-0.114809
O	5.534333	3.241948	10.144322		-0.587545	-0.601657	-0.187130
O	2.920980	4.257928	23.083891		0.426586	-0.324595	0.114809
O	4.605928	4.871739	21.763396		0.587545	-0.601657	0.187130
O	0.200681	1.553366	11.891411		-0.426586	-0.324595	-0.114809
O	-1.484267	2.167177	13.211906		-0.587545	-0.601657	-0.187130
				60			
Bu, (2.40 THz), intensity=0.0963							
H	2.636038	2.841927	1.306092		-0.289077	0.123743	-0.252047
H	3.356104	4.417292	3.058800		0.344593	-0.239427	-0.191266
H	2.033967	4.641224	5.132544		0.798285	-0.285065	0.104830
H	-0.015229	3.297549	5.438473		0.558027	0.126016	0.277589
H	-0.732874	1.729957	3.670359		-0.103580	0.513084	0.202002
H	-0.766176	-0.109805	0.833090		-0.572623	0.562313	-0.033876
H	2.342432	5.546490	10.431063		-0.289077	-0.123743	-0.252047
H	1.622367	7.121854	8.678355		0.344593	0.239427	-0.191266
H	2.944504	7.345787	6.604612		0.798285	0.285065	0.104830
H	4.993699	6.002111	6.298682		0.558027	-0.126016	0.277589
H	5.711345	4.434520	8.066796		-0.103580	-0.513084	0.202002
H	5.744647	2.594757	10.904065		-0.572623	-0.562313	-0.033876
H	1.414028	2.567198	22.050136		-0.289077	0.123743	-0.252047
H	0.693962	0.991833	20.297429		0.344593	-0.239427	-0.191266
H	2.016099	0.767901	18.223685		0.798285	-0.285065	0.104830
H	4.065294	2.111576	17.917755		0.558027	0.126016	0.277589
H	4.782940	3.679168	19.685870		-0.103580	0.513084	0.202002
H	4.816242	5.518930	22.523138		-0.572623	0.562313	-0.033876
H	1.707633	-0.137365	12.925166		-0.289077	-0.123743	-0.252047
H	2.427699	-1.712729	14.677873		0.344593	0.239427	-0.191266
H	1.105562	-1.936662	16.751617		0.798285	0.285065	0.104830
H	-0.943633	-0.592986	17.057547		0.558027	-0.126016	0.277589
H	-1.661279	0.974605	15.289433		-0.103580	-0.513084	0.202002
H	-1.694581	2.814368	12.452164		-0.572623	-0.562313	-0.033876
C	0.504476	1.247582	1.323252		-0.451039	0.432983	-0.036018
C	0.911312	2.186038	2.385754		-0.229013	0.331065	-0.030970
C	2.060337	2.946578	2.215307		-0.111719	0.134169	-0.142682
C	2.461350	3.825160	3.199930		0.251977	-0.077459	-0.105394
C	1.718447	3.949813	4.360759		0.503272	-0.097728	0.056728
C	0.570737	3.195965	4.533631		0.364608	0.131536	0.152026
C	0.166542	2.317166	3.550619		-0.008203	0.349598	0.106561
C	4.473995	3.952145	10.413903		-0.451039	-0.432983	-0.036018
C	4.067158	4.890601	9.351401		-0.229013	-0.331065	-0.030970
C	2.918134	5.651140	9.521849		-0.111719	-0.134169	-0.142682
C	2.517120	6.529723	8.537225		0.251977	0.077459	-0.105394
C	3.260024	6.654376	7.376396		0.503272	0.097728	0.056728
C	4.407733	5.900528	7.203525		0.364608	-0.131536	0.152026
C	4.811928	5.021729	8.186536		-0.008203	-0.349598	0.106561
C	3.545590	4.161543	22.032977		-0.451039	0.432983	-0.036018
C	3.138753	3.223087	20.970474		-0.229013	0.331065	-0.030970
C	1.989729	2.462547	21.140922		-0.111719	0.134169	-0.142682
C	1.588715	1.583965	20.156299		0.251977	-0.077459	-0.105394
C	2.331619	1.459312	18.995470		0.503272	-0.097728	0.056728
C	3.479328	2.213160	18.822598		0.364608	0.131536	0.152026
C	3.883524	3.091959	19.805609		-0.008203	0.349598	0.106561
C	-0.423929	1.456980	12.942325		-0.451039	-0.432983	-0.036018
C	-0.017093	0.518524	14.004828		-0.229013	-0.331065	-0.030970
C	1.131932	-0.242015	13.834380		-0.111719	-0.134169	-0.142682
C	1.532946	-1.120598	14.819003		0.251977	0.077459	-0.105394
C	0.790042	-1.245251	15.979833		0.503272	0.097728	0.056728
C	-0.357667	-0.491403	16.152704		0.364608	-0.131536	0.152026
C	-0.761863	0.387396	15.169693		-0.008203	-0.349598	0.106561
O	1.129086	1.151197	0.272338		-0.432475	0.318928	-0.013776
O	-0.555862	0.537386	1.592833		-0.584700	0.603882	-0.076783
O	3.849385	3.855760	11.464817		-0.432475	-0.318928	-0.013776
O	5.534333	3.241948	10.144322		-0.584700	-0.603882	-0.076783
O	2.920980	4.257928	23.083891		-0.432475	0.318928	-0.013776
O	4.605928	4.871739	21.763396		-0.584700	0.603882	-0.076783
O	0.200681	1.553366	11.891411		-0.432475	-0.318928	-0.013776
O	-1.484267	2.167177	13.211906		-0.584700	-0.603882	-0.076783
				60			
Ag, (2.87 THz), IR inactive						
H	2.636038	2.841927	1.306092		0.382374	-0.188350	0.333892
H	3.356104	4.417292	3.058800		-0.209227	0.267063	0.170137
H	2.033967	4.641224	5.132544		-0.699288	0.554264	-0.180144
H	-0.015229	3.297549	5.438473		-0.478436	0.194957	-0.247429
H	-0.732874	1.729957	3.670359		0.181400	-0.353999	-0.023396
H	-0.766176	-0.109805	0.833090		0.445737	-0.463264	0.215489
H	2.342432	5.546490	10.431063		-0.382374	-0.188350	-0.333892
H	1.622367	7.121854	8.678355		0.209227	0.267063	-0.170137
H	2.944504	7.345787	6.604612		0.699288	0.554264	0.180144
H	4.993699	6.002111	6.298682		0.478436	0.194957	0.247429
H	5.711345	4.434520	8.066796		-0.181400	-0.353999	0.023396
H	5.744647	2.594757	10.904065		-0.445737	-0.463264	-0.215489
H	1.414028	2.567198	22.050136		-0.382374	0.188350	-0.333892
H	0.693962	0.991833	20.297429		0.209227	-0.267063	-0.170137
H	2.016099	0.767901	18.223685		0.699288	-0.554264	0.180144
H	4.065294	2.111576	17.917755		0.478436	-0.194957	0.247429
H	4.782940	3.679168	19.685870		-0.181400	0.353999	0.023396
H	4.816242	5.518930	22.523138		-0.445737	0.463264	-0.215489
H	1.707633	-0.137365	12.925166		0.382374	0.188350	0.333892
H	2.427699	-1.712729	14.677873		-0.209227	-0.267063	0.170137
H	1.105562	-1.936662	16.751617		-0.699288	-0.554264	-0.180144
H	-0.943633	-0.592986	17.057547		-0.478436	-0.194957	-0.247429
H	-1.661279	0.974605	15.289433		0.181400	0.353999	-0.023396
H	-1.694581	2.814368	12.452164		0.445737	0.463264	0.215489
C	0.504476	1.247582	1.323252		0.425131	-0.348459	0.168257
C	0.911312	2.186038	2.385754		0.312288	-0.298461	0.167677
C	2.060337	2.946578	2.215307		0.215605	-0.140181	0.225112
C	2.461350	3.825160	3.199930		-0.132225	0.138323	0.122846
C	1.718447	3.949813	4.360759		-0.399473	0.286733	-0.062904
C	0.570737	3.195965	4.533631		-0.272341	0.088691	-0.101584
C	0.166542	2.317166	3.550619		0.099649	-0.220270	0.024884
C	4.473995	3.952145	10.413903		-0.425131	-0.348459	-0.168257
C	4.067158	4.890601	9.351401		-0.312288	-0.298461	-0.167677
C	2.918134	5.651140	9.521849		-0.215605	-0.140181	-0.225112
C	2.517120	6.529723	8.537225		0.132225	0.138323	-0.122846
C	3.260024	6.654376	7.376396		0.399473	0.286733	0.062904
C	4.407733	5.900528	7.203525		0.272341	0.088691	0.101584
C	4.811928	5.021729	8.186536		-0.099649	-0.220270	-0.024884
C	3.545590	4.161543	22.032977		-0.425131	0.348459	-0.168257
C	3.138753	3.223087	20.970474		-0.312288	0.298461	-0.167677
C	1.989729	2.462547	21.140922		-0.215605	0.140181	-0.225112
C	1.588715	1.583965	20.156299		0.132225	-0.138323	-0.122846
C	2.331619	1.459312	18.995470		0.399473	-0.286733	0.062904
C	3.479328	2.213160	18.822598		0.272341	-0.088691	0.101584
C	3.883524	3.091959	19.805609		-0.099649	0.220270	-0.024884
C	-0.423929	1.456980	12.942325		0.425131	0.348459	0.168257
C	-0.017093	0.518524	14.004828		0.312288	0.298461	0.167677
C	1.131932	-0.242015	13.834380		0.215605	0.140181	0.225112
C	1.532946	-1.120598	14.819003		-0.132225	-0.138323	0.122846
C	0.790042	-1.245251	15.979833		-0.399473	-0.286733	-0.062904
C	-0.357667	-0.491403	16.152704		-0.272341	-0.088691	-0.101584
C	-0.761863	0.387396	15.169693		0.099649	0.220270	0.024884
O	1.129086	1.151197	0.272338		0.171565	-0.003771	-0.014858
O	-0.555862	0.537386	1.592833		0.707675	-0.691732	0.346829
O	3.849385	3.855760	11.464817		-0.171565	-0.003771	0.014858
O	5.534333	3.241948	10.144322		-0.707675	-0.691732	-0.346829
O	2.920980	4.257928	23.083891		-0.171565	0.003771	0.014858
O	4.605928	4.871739	21.763396		-0.707675	0.691732	-0.346829
O	0.200681	1.553366	11.891411		0.171565	0.003771	-0.014858
O	-1.484267	2.167177	13.211906		0.707675	0.691732	0.346829
				60			
Bg, (2.89 THz), IR inactive							
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H	3.356104	4.417292	3.058800		-0.185025	0.257294	0.170905
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H	-0.766176	-0.109805	0.833090		0.461505	-0.471423	0.217624
H	2.342432	5.546490	10.431063		0.406461	0.182836	0.322489
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H	5.744647	2.594757	10.904065		0.461505	0.471423	0.217624
H	1.414028	2.567198	22.050136		-0.406461	0.182836	-0.322489
H	0.693962	0.991833	20.297429		0.185025	-0.257294	-0.170905
H	2.016099	0.767901	18.223685		0.687416	-0.540821	0.183252
H	4.065294	2.111576	17.917755		0.494127	-0.215092	0.282061
H	4.782940	3.679168	19.685870		-0.164103	0.308445	0.075096
H	4.816242	5.518930	22.523138		-0.461505	0.471423	-0.217624
H	1.707633	-0.137365	12.925166		-0.406461	-0.182836	-0.322489
H	2.427699	-1.712729	14.677873		0.185025	0.257294	-0.170905
H	1.105562	-1.936662	16.751617		0.687416	0.540821	0.183252
H	-0.943633	-0.592986	17.057547		0.494127	0.215092	0.282061
H	-1.661279	0.974605	15.289433		-0.164103	-0.308445	0.075096
H	-1.694581	2.814368	12.452164		-0.461505	-0.471423	-0.217624
C	0.504476	1.247582	1.323252		0.432971	-0.333417	0.145807
C	0.911312	2.186038	2.385754		0.316739	-0.275266	0.138175
C	2.060337	2.946578	2.215307		0.229734	-0.129048	0.206803
C	2.461350	3.825160	3.199930		-0.118330	0.141271	0.111893
C	1.718447	3.949813	4.360759		-0.394383	0.292872	-0.079528
C	0.570737	3.195965	4.533631		-0.280836	0.112258	-0.132272
C	0.166542	2.317166	3.550619		0.091647	-0.187007	-0.014121
C	4.473995	3.952145	10.413903		0.432971	0.333417	0.145807
C	4.067158	4.890601	9.351401		0.316739	0.275266	0.138175
C	2.918134	5.651140	9.521849		0.229734	0.129048	0.206803
C	2.517120	6.529723	8.537225		-0.118330	-0.141271	0.111893
C	3.260024	6.654376	7.376396		-0.394383	-0.292872	-0.079528
C	4.407733	5.900528	7.203525		-0.280836	-0.112258	-0.132272
C	4.811928	5.021729	8.186536		0.091647	0.187007	-0.014121
C	3.545590	4.161543	22.032977		-0.432971	0.333417	-0.145807
C	3.138753	3.223087	20.970474		-0.316739	0.275266	-0.138175
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C	1.588715	1.583965	20.156299		0.118330	-0.141271	-0.111893
C	2.331619	1.459312	18.995470		0.394383	-0.292872	0.079528
C	3.479328	2.213160	18.822598		0.280836	-0.112258	0.132272
C	3.883524	3.091959	19.805609		-0.091647	0.187007	0.014121
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C	-0.017093	0.518524	14.004828		-0.316739	-0.275266	-0.138175
C	1.131932	-0.242015	13.834380		-0.229734	-0.129048	-0.206803
C	1.532946	-1.120598	14.819003		0.118330	0.141271	-0.111893
C	0.790042	-1.245251	15.979833		0.394383	0.292872	0.079528
C	-0.357667	-0.491403	16.152704		0.280836	0.112258	0.132272
C	-0.761863	0.387396	15.169693		-0.091647	-0.187007	0.014121
O	1.129086	1.151197	0.272338		0.170350	0.013701	-0.043520
O	-0.555862	0.537386	1.592833		0.729852	-0.690591	0.341147
O	3.849385	3.855760	11.464817		0.170350	-0.013701	-0.043520
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O	4.605928	4.871739	21.763396		-0.729852	0.690591	-0.341147
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O	-1.484267	2.167177	13.211906		-0.729852	-0.690591	-0.341147
				60			
Au, (3.02 THz), intensity=0.1622							
H	2.636038	2.841927	1.306092		-0.357008	-0.296007	-0.298697
H	3.356104	4.417292	3.058800		-0.006025	0.116243	-0.817901
H	2.033967	4.641224	5.132544		0.471696	0.490772	-0.551103
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H	2.944504	7.345787	6.604612		-0.471696	0.490772	0.551103
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H	5.711345	4.434520	8.066796		-0.245761	0.049922	-0.726276
H	5.744647	2.594757	10.904065		0.207776	-0.306295	-0.562016
H	1.414028	2.567198	22.050136		-0.357008	-0.296007	-0.298697
H	0.693962	0.991833	20.297429		-0.006025	0.116243	-0.817901
H	2.016099	0.767901	18.223685		0.471696	0.490772	-0.551103
H	4.065294	2.111576	17.917755		0.624984	0.446868	0.225849
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H	-1.694581	2.814368	12.452164		0.207776	-0.306295	-0.562016
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C	2.461350	3.825160	3.199930		0.059718	0.100424	-0.478170
C	1.718447	3.949813	4.360759		0.330063	0.308006	-0.328726
C	0.570737	3.195965	4.533631		0.409006	0.284672	0.104722
C	0.166542	2.317166	3.550619		0.199320	0.055998	0.387642
C	4.473995	3.952145	10.413903		0.200186	-0.295598	-0.431034
C	4.067158	4.890601	9.351401		0.072052	-0.146274	-0.240770
C	2.918134	5.651140	9.521849		0.140490	-0.130686	0.183129
C	2.517120	6.529723	8.537225		-0.059718	0.100424	0.478170
C	3.260024	6.654376	7.376396		-0.330063	0.308006	0.328726
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C	4.811928	5.021729	8.186536		-0.199320	0.055998	-0.387642
C	3.545590	4.161543	22.032977		-0.200186	-0.295598	0.431034
C	3.138753	3.223087	20.970474		-0.072052	-0.146274	0.240770
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C	1.588715	1.583965	20.156299		0.059718	0.100424	-0.478170
C	2.331619	1.459312	18.995470		0.330063	0.308006	-0.328726
C	3.479328	2.213160	18.822598		0.409006	0.284672	0.104722
C	3.883524	3.091959	19.805609		0.199320	0.055998	0.387642
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C	1.532946	-1.120598	14.819003		-0.059718	0.100424	0.478170
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C	-0.357667	-0.491403	16.152704		-0.409006	0.284672	-0.104722
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O	1.129086	1.151197	0.272338		-0.243218	-0.393420	0.419692
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				60			
Bu, (3.02 THz), intensity=0.0743							
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H	5.711345	4.434520	8.066796		0.193132	-0.104609	0.634917
H	5.744647	2.594757	10.904065		-0.145988	0.372692	0.554077
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H	-1.694581	2.814368	12.452164		-0.145988	0.372692	0.554077
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C	0.570737	3.195965	4.533631		0.327606	0.364284	0.011054
C	0.166542	2.317166	3.550619		0.159511	0.094345	0.313765
C	4.473995	3.952145	10.413903		-0.156332	0.341262	0.412278
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C	3.260024	6.654376	7.376396		0.268563	-0.362330	-0.398767
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C	4.811928	5.021729	8.186536		0.159511	-0.094345	0.313765
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O	3.849385	3.855760	11.464817		-0.206959	0.425998	0.395066
O	5.534333	3.241948	10.144322		-0.127986	0.351832	0.519914
O	2.920980	4.257928	23.083891		-0.206959	-0.425998	0.395066
O	4.605928	4.871739	21.763396		-0.127986	-0.351832	0.519914
O	0.200681	1.553366	11.891411		-0.206959	0.425998	0.395066
O	-1.484267	2.167177	13.211906		-0.127986	0.351832	0.519914
				60			
Ag, (3.66 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.002177	0.286605	-0.026763
H	3.356104	4.417292	3.058800		0.203930	-0.315908	0.423036
H	2.033967	4.641224	5.132544		0.150983	-0.601861	0.415631
H	-0.015229	3.297549	5.438473		-0.194199	-0.195331	-0.085110
H	-0.732874	1.729957	3.670359		-0.309527	0.284025	-0.459098
H	-0.766176	-0.109805	0.833090		0.435539	-0.457781	0.187727
H	2.342432	5.546490	10.431063		-0.002177	0.286605	0.026763
H	1.622367	7.121854	8.678355		-0.203930	-0.315908	-0.423036
H	2.944504	7.345787	6.604612		-0.150983	-0.601861	-0.415631
H	4.993699	6.002111	6.298682		0.194199	-0.195331	0.085110
H	5.711345	4.434520	8.066796		0.309527	0.284025	0.459098
H	5.744647	2.594757	10.904065		-0.435539	-0.457781	-0.187727
H	1.414028	2.567198	22.050136		-0.002177	-0.286605	0.026763
H	0.693962	0.991833	20.297429		-0.203930	0.315908	-0.423036
H	2.016099	0.767901	18.223685		-0.150983	0.601861	-0.415631
H	4.065294	2.111576	17.917755		0.194199	0.195331	0.085110
H	4.782940	3.679168	19.685870		0.309527	-0.284025	0.459098
H	4.816242	5.518930	22.523138		-0.435539	0.457781	-0.187727
H	1.707633	-0.137365	12.925166		0.002177	-0.286605	-0.026763
H	2.427699	-1.712729	14.677873		0.203930	0.315908	0.423036
H	1.105562	-1.936662	16.751617		0.150983	0.601861	0.415631
H	-0.943633	-0.592986	17.057547		-0.194199	0.195331	-0.085110
H	-1.661279	0.974605	15.289433		-0.309527	-0.284025	-0.459098
H	-1.694581	2.814368	12.452164		0.435539	0.457781	0.187727
C	0.504476	1.247582	1.323252		-0.106653	0.309104	-0.287912
C	0.911312	2.186038	2.385754		-0.154852	0.291030	-0.254247
C	2.060337	2.946578	2.215307		-0.047696	0.173184	-0.043382
C	2.461350	3.825160	3.199930		0.068182	-0.161691	0.211882
C	1.718447	3.949813	4.360759		0.037206	-0.319588	0.208793
C	0.570737	3.195965	4.533631		-0.143862	-0.104948	-0.063148
C	0.166542	2.317166	3.550619		-0.221284	0.182610	-0.283389
C	4.473995	3.952145	10.413903		0.106653	0.309104	0.287912
C	4.067158	4.890601	9.351401		0.154852	0.291030	0.254247
C	2.918134	5.651140	9.521849		0.047696	0.173184	0.043382
C	2.517120	6.529723	8.537225		-0.068182	-0.161691	-0.211882
C	3.260024	6.654376	7.376396		-0.037206	-0.319588	-0.208793
C	4.407733	5.900528	7.203525		0.143862	-0.104948	0.063148
C	4.811928	5.021729	8.186536		0.221284	0.182610	0.283389
C	3.545590	4.161543	22.032977		0.106653	-0.309104	0.287912
C	3.138753	3.223087	20.970474		0.154852	-0.291030	0.254247
C	1.989729	2.462547	21.140922		0.047696	-0.173184	0.043382
C	1.588715	1.583965	20.156299		-0.068182	0.161691	-0.211882
C	2.331619	1.459312	18.995470		-0.037206	0.319588	-0.208793
C	3.479328	2.213160	18.822598		0.143862	0.104948	0.063148
C	3.883524	3.091959	19.805609		0.221284	-0.182610	0.283389
C	-0.423929	1.456980	12.942325		-0.106653	-0.309104	-0.287912
C	-0.017093	0.518524	14.004828		-0.154852	-0.291030	-0.254247
C	1.131932	-0.242015	13.834380		-0.047696	-0.173184	-0.043382
C	1.532946	-1.120598	14.819003		0.068182	0.161691	0.211882
C	0.790042	-1.245251	15.979833		0.037206	0.319588	0.208793
C	-0.357667	-0.491403	16.152704		-0.143862	0.104948	-0.063148
C	-0.761863	0.387396	15.169693		-0.221284	-0.182610	-0.283389
O	1.129086	1.151197	0.272338		-0.470988	0.758238	-0.554141
O	-0.555862	0.537386	1.592833		0.409142	-0.305219	0.079228
O	3.849385	3.855760	11.464817		0.470988	0.758238	0.554141
O	5.534333	3.241948	10.144322		-0.409142	-0.305219	-0.079228
O	2.920980	4.257928	23.083891		0.470988	-0.758238	0.554141
O	4.605928	4.871739	21.763396		-0.409142	0.305219	-0.079228
O	0.200681	1.553366	11.891411		-0.470988	-0.758238	-0.554141
O	-1.484267	2.167177	13.211906		0.409142	0.305219	0.079228
				60			
Bg, (3.68 THz), IR inactive							
H	2.636038	2.841927	1.306092		-0.020312	0.293618	-0.036002
H	3.356104	4.417292	3.058800		0.198203	-0.324644	0.421030
H	2.033967	4.641224	5.132544		0.162514	-0.624007	0.425183
H	-0.015229	3.297549	5.438473		-0.170015	-0.235929	-0.063540
H	-0.732874	1.729957	3.670359		-0.304823	0.261912	-0.445268
H	-0.766176	-0.109805	0.833090		0.417251	-0.447416	0.177146
H	2.342432	5.546490	10.431063		-0.020312	-0.293618	-0.036002
H	1.622367	7.121854	8.678355		0.198203	0.324644	0.421030
H	2.944504	7.345787	6.604612		0.162514	0.624007	0.425183
H	4.993699	6.002111	6.298682		-0.170015	0.235929	-0.063540
H	5.711345	4.434520	8.066796		-0.304823	-0.261912	-0.445268
H	5.744647	2.594757	10.904065		0.417251	0.447416	0.177146
H	1.414028	2.567198	22.050136		0.020312	-0.293618	0.036002
H	0.693962	0.991833	20.297429		-0.198203	0.324644	-0.421030
H	2.016099	0.767901	18.223685		-0.162514	0.624007	-0.425183
H	4.065294	2.111576	17.917755		0.170015	0.235929	0.063540
H	4.782940	3.679168	19.685870		0.304823	-0.261912	0.445268
H	4.816242	5.518930	22.523138		-0.417251	0.447416	-0.177146
H	1.707633	-0.137365	12.925166		0.020312	0.293618	0.036002
H	2.427699	-1.712729	14.677873		-0.198203	-0.324644	-0.421030
H	1.105562	-1.936662	16.751617		-0.162514	-0.624007	-0.425183
H	-0.943633	-0.592986	17.057547		0.170015	-0.235929	0.063540
H	-1.661279	0.974605	15.289433		0.304823	0.261912	0.445268
H	-1.694581	2.814368	12.452164		-0.417251	-0.447416	-0.177146
C	0.504476	1.247582	1.323252		-0.125745	0.315307	-0.292122
C	0.911312	2.186038	2.385754		-0.165342	0.286158	-0.252819
C	2.060337	2.946578	2.215307		-0.060101	0.170146	-0.045171
C	2.461350	3.825160	3.199930		0.066110	-0.174750	0.214660
C	1.718447	3.949813	4.360759		0.047369	-0.344431	0.220494
C	0.570737	3.195965	4.533631		-0.128976	-0.135691	-0.048025
C	0.166542	2.317166	3.550619		-0.218051	0.162406	-0.272076
C	4.473995	3.952145	10.413903		-0.125745	-0.315307	-0.292122
C	4.067158	4.890601	9.351401		-0.165342	-0.286158	-0.252819
C	2.918134	5.651140	9.521849		-0.060101	-0.170146	-0.045171
C	2.517120	6.529723	8.537225		0.066110	0.174750	0.214660
C	3.260024	6.654376	7.376396		0.047369	0.344431	0.220494
C	4.407733	5.900528	7.203525		-0.128976	0.135691	-0.048025
C	4.811928	5.021729	8.186536		-0.218051	-0.162406	-0.272076
C	3.545590	4.161543	22.032977		0.125745	-0.315307	0.292122
C	3.138753	3.223087	20.970474		0.165342	-0.286158	0.252819
C	1.989729	2.462547	21.140922		0.060101	-0.170146	0.045171
C	1.588715	1.583965	20.156299		-0.066110	0.174750	-0.214660
C	2.331619	1.459312	18.995470		-0.047369	0.344431	-0.220494
C	3.479328	2.213160	18.822598		0.128976	0.135691	0.048025
C	3.883524	3.091959	19.805609		0.218051	-0.162406	0.272076
C	-0.423929	1.456980	12.942325		0.125745	0.315307	0.292122
C	-0.017093	0.518524	14.004828		0.165342	0.286158	0.252819
C	1.131932	-0.242015	13.834380		0.060101	0.170146	0.045171
C	1.532946	-1.120598	14.819003		-0.066110	-0.174750	-0.214660
C	0.790042	-1.245251	15.979833		-0.047369	-0.344431	-0.220494
C	-0.357667	-0.491403	16.152704		0.128976	-0.135691	0.048025
C	-0.761863	0.387396	15.169693		0.218051	0.162406	0.272076
O	1.129086	1.151197	0.272338		-0.483759	0.761114	-0.554520
O	-0.555862	0.537386	1.592833		0.379897	-0.286810	0.065749
O	3.849385	3.855760	11.464817		-0.483759	-0.761114	-0.554520
O	5.534333	3.241948	10.144322		0.379897	0.286810	0.065749
O	2.920980	4.257928	23.083891		0.483759	-0.761114	0.554520
O	4.605928	4.871739	21.763396		-0.379897	0.286810	-0.065749
O	0.200681	1.553366	11.891411		0.483759	0.761114	0.554520
O	-1.484267	2.167177	13.211906		-0.379897	-0.286810	-0.065749
				60			
Bg, (3.88 THz), IR inactive							
H	2.636038	2.841927	1.306092		-0.505373	-0.643659	-0.409710
H	3.356104	4.417292	3.058800		-0.031745	-0.354867	-0.829701
H	2.033967	4.641224	5.132544		0.319832	0.125003	-0.657037
H	-0.015229	3.297549	5.438473		0.307860	0.323953	-0.029367
H	-0.732874	1.729957	3.670359		-0.132672	0.008102	0.390476
H	-0.766176	-0.109805	0.833090		-0.050653	-0.508654	0.088781
H	2.342432	5.546490	10.431063		-0.505373	0.643659	-0.409710
H	1.622367	7.121854	8.678355		-0.031745	0.354867	-0.829701
H	2.944504	7.345787	6.604612		0.319832	-0.125003	-0.657037
H	4.993699	6.002111	6.298682		0.307860	-0.323953	-0.029367
H	5.711345	4.434520	8.066796		-0.132672	-0.008102	0.390476
H	5.744647	2.594757	10.904065		-0.050653	0.508654	0.088781
H	1.414028	2.567198	22.050136		0.505373	0.643659	0.409710
H	0.693962	0.991833	20.297429		0.031745	0.354867	0.829701
H	2.016099	0.767901	18.223685		-0.319832	-0.125003	0.657037
H	4.065294	2.111576	17.917755		-0.307860	-0.323953	0.029367
H	4.782940	3.679168	19.685870		0.132672	-0.008102	-0.390476
H	4.816242	5.518930	22.523138		0.050653	0.508654	-0.088781
H	1.707633	-0.137365	12.925166		0.505373	-0.643659	0.409710
H	2.427699	-1.712729	14.677873		0.031745	-0.354867	0.829701
H	1.105562	-1.936662	16.751617		-0.319832	0.125003	0.657037
H	-0.943633	-0.592986	17.057547		-0.307860	0.323953	0.029367
H	-1.661279	0.974605	15.289433		0.132672	0.008102	-0.390476
H	-1.694581	2.814368	12.452164		0.050653	-0.508654	-0.088781
C	0.504476	1.247582	1.323252		-0.431970	-0.316439	0.141521
C	0.911312	2.186038	2.385754		-0.325955	-0.287004	0.027285
C	2.060337	2.946578	2.215307		-0.307069	-0.405927	-0.316957
C	2.461350	3.825160	3.199930		-0.050503	-0.262733	-0.570049
C	1.718447	3.949813	4.360759		0.148251	-0.001415	-0.473003
C	0.570737	3.195965	4.533631		0.128954	0.104728	-0.120398
C	0.166542	2.317166	3.550619		-0.116292	-0.065880	0.126561
C	4.473995	3.952145	10.413903		-0.431970	0.316439	0.141521
C	4.067158	4.890601	9.351401		-0.325955	0.287004	0.027285
C	2.918134	5.651140	9.521849		-0.307069	0.405927	-0.316957
C	2.517120	6.529723	8.537225		-0.050503	0.262733	-0.570049
C	3.260024	6.654376	7.376396		0.148251	0.001415	-0.473003
C	4.407733	5.900528	7.203525		0.128954	-0.104728	-0.120398
C	4.811928	5.021729	8.186536		-0.116292	0.065880	0.126561
C	3.545590	4.161543	22.032977		0.431970	0.316439	-0.141521
C	3.138753	3.223087	20.970474		0.325955	0.287004	-0.027285
C	1.989729	2.462547	21.140922		0.307069	0.405927	0.316957
C	1.588715	1.583965	20.156299		0.050503	0.262733	0.570049
C	2.331619	1.459312	18.995470		-0.148251	0.001415	0.473003
C	3.479328	2.213160	18.822598		-0.128954	-0.104728	0.120398
C	3.883524	3.091959	19.805609		0.116292	0.065880	-0.126561
C	-0.423929	1.456980	12.942325		0.431970	-0.316439	-0.141521
C	-0.017093	0.518524	14.004828		0.325955	-0.287004	-0.027285
C	1.131932	-0.242015	13.834380		0.307069	-0.405927	0.316957
C	1.532946	-1.120598	14.819003		0.050503	-0.262733	0.570049
C	0.790042	-1.245251	15.979833		-0.148251	-0.001415	0.473003
C	-0.357667	-0.491403	16.152704		-0.128954	0.104728	0.120398
C	-0.761863	0.387396	15.169693		0.116292	-0.065880	-0.126561
O	1.129086	1.151197	0.272338		-0.561152	-0.044608	0.021166
O	-0.555862	0.537386	1.592833		-0.193138	-0.567568	0.255428
O	3.849385	3.855760	11.464817		-0.561152	0.044608	0.021166
O	5.534333	3.241948	10.144322		-0.193138	0.567568	0.255428
O	2.920980	4.257928	23.083891		0.561152	0.044608	-0.021166
O	4.605928	4.871739	21.763396		0.193138	0.567568	-0.255428
O	0.200681	1.553366	11.891411		0.561152	-0.044608	-0.021166
O	-1.484267	2.167177	13.211906		0.193138	-0.567568	-0.255428
				60			
Ag, (3.89 THz), IR inactive							
H	2.636038	2.841927	1.306092		-0.519008	-0.626512	-0.414033
H	3.356104	4.417292	3.058800		-0.035806	-0.346126	-0.831256
H	2.033967	4.641224	5.132544		0.329477	0.122051	-0.648981
H	-0.015229	3.297549	5.438473		0.319600	0.317760	-0.016620
H	-0.732874	1.729957	3.670359		-0.127617	0.005712	0.402977
H	-0.766176	-0.109805	0.833090		-0.049164	-0.506420	0.095029
H	2.342432	5.546490	10.431063		0.519008	-0.626512	0.414033
H	1.622367	7.121854	8.678355		0.035806	-0.346126	0.831256
H	2.944504	7.345787	6.604612		-0.329477	0.122051	0.648981
H	4.993699	6.002111	6.298682		-0.319600	0.317760	0.016620
H	5.711345	4.434520	8.066796		0.127617	0.005712	-0.402977
H	5.744647	2.594757	10.904065		0.049164	-0.506420	-0.095029
H	1.414028	2.567198	22.050136		0.519008	0.626512	0.414033
H	0.693962	0.991833	20.297429		0.035806	0.346126	0.831256
H	2.016099	0.767901	18.223685		-0.329477	-0.122051	0.648981
H	4.065294	2.111576	17.917755		-0.319600	-0.317760	0.016620
H	4.782940	3.679168	19.685870		0.127617	-0.005712	-0.402977
H	4.816242	5.518930	22.523138		0.049164	0.506420	-0.095029
H	1.707633	-0.137365	12.925166		-0.519008	0.626512	-0.414033
H	2.427699	-1.712729	14.677873		-0.035806	0.346126	-0.831256
H	1.105562	-1.936662	16.751617		0.329477	-0.122051	-0.648981
H	-0.943633	-0.592986	17.057547		0.319600	-0.317760	-0.016620
H	-1.661279	0.974605	15.289433		-0.127617	-0.005712	0.402977
H	-1.694581	2.814368	12.452164		-0.049164	0.506420	0.095029
C	0.504476	1.247582	1.323252		-0.437224	-0.309866	0.144679
C	0.911312	2.186038	2.385754		-0.329388	-0.281712	0.031801
C	2.060337	2.946578	2.215307		-0.314251	-0.395618	-0.316385
C	2.461350	3.825160	3.199930		-0.051851	-0.257085	-0.567682
C	1.718447	3.949813	4.360759		0.155471	-0.003803	-0.464625
C	0.570737	3.195965	4.533631		0.138492	0.099821	-0.109121
C	0.166542	2.317166	3.550619		-0.111920	-0.067447	0.136786
C	4.473995	3.952145	10.413903		0.437224	-0.309866	-0.144679
C	4.067158	4.890601	9.351401		0.329388	-0.281712	-0.031801
C	2.918134	5.651140	9.521849		0.314251	-0.395618	0.316385
C	2.517120	6.529723	8.537225		0.051851	-0.257085	0.567682
C	3.260024	6.654376	7.376396		-0.155471	-0.003803	0.464625
C	4.407733	5.900528	7.203525		-0.138492	0.099821	0.109121
C	4.811928	5.021729	8.186536		0.111920	-0.067447	-0.136786
C	3.545590	4.161543	22.032977		0.437224	0.309866	-0.144679
C	3.138753	3.223087	20.970474		0.329388	0.281712	-0.031801
C	1.989729	2.462547	21.140922		0.314251	0.395618	0.316385
C	1.588715	1.583965	20.156299		0.051851	0.257085	0.567682
C	2.331619	1.459312	18.995470		-0.155471	0.003803	0.464625
C	3.479328	2.213160	18.822598		-0.138492	-0.099821	0.109121
C	3.883524	3.091959	19.805609		0.111920	0.067447	-0.136786
C	-0.423929	1.456980	12.942325		-0.437224	0.309866	0.144679
C	-0.017093	0.518524	14.004828		-0.329388	0.281712	0.031801
C	1.131932	-0.242015	13.834380		-0.314251	0.395618	-0.316385
C	1.532946	-1.120598	14.819003		-0.051851	0.257085	-0.567682
C	0.790042	-1.245251	15.979833		0.155471	0.003803	-0.464625
C	-0.357667	-0.491403	16.152704		0.138492	-0.099821	-0.109121
C	-0.761863	0.387396	15.169693		-0.111920	0.067447	0.136786
O	1.129086	1.151197	0.272338		-0.570001	-0.036109	0.022498
O	-0.555862	0.537386	1.592833		-0.196285	-0.564996	0.260566
O	3.849385	3.855760	11.464817		0.570001	-0.036109	-0.022498
O	5.534333	3.241948	10.144322		0.196285	-0.564996	-0.260566
O	2.920980	4.257928	23.083891		0.570001	0.036109	-0.022498
O	4.605928	4.871739	21.763396		0.196285	0.564996	-0.260566
O	0.200681	1.553366	11.891411		-0.570001	0.036109	0.022498
O	-1.484267	2.167177	13.211906		-0.196285	0.564996	0.260566
				60			
Bg, (4.15 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.126925	-0.126654	-0.266445
H	3.356104	4.417292	3.058800		-0.206264	-0.097451	-0.139867
H	2.033967	4.641224	5.132544		-0.460206	-0.264282	-0.301958
H	-0.015229	3.297549	5.438473		-0.325470	-0.496272	-0.486331
H	-0.732874	1.729957	3.670359		-0.002918	-0.512397	-0.643792
H	-0.766176	-0.109805	0.833090		-0.179902	-0.122973	-0.499330
H	2.342432	5.546490	10.431063		0.126925	0.126654	-0.266445
H	1.622367	7.121854	8.678355		-0.206264	0.097451	-0.139867
H	2.944504	7.345787	6.604612		-0.460206	0.264282	-0.301958
H	4.993699	6.002111	6.298682		-0.325470	0.496272	-0.486331
H	5.711345	4.434520	8.066796		-0.002918	0.512397	-0.643792
H	5.744647	2.594757	10.904065		-0.179902	0.122973	-0.499330
H	1.414028	2.567198	22.050136		-0.126925	0.126654	0.266445
H	0.693962	0.991833	20.297429		0.206264	0.097451	0.139867
H	2.016099	0.767901	18.223685		0.460206	0.264282	0.301958
H	4.065294	2.111576	17.917755		0.325470	0.496272	0.486331
H	4.782940	3.679168	19.685870		0.002918	0.512397	0.643792
H	4.816242	5.518930	22.523138		0.179902	0.122973	0.499330
H	1.707633	-0.137365	12.925166		-0.126925	-0.126654	0.266445
H	2.427699	-1.712729	14.677873		0.206264	-0.097451	0.139867
H	1.105562	-1.936662	16.751617		0.460206	-0.264282	0.301958
H	-0.943633	-0.592986	17.057547		0.325470	-0.496272	0.486331
H	-1.661279	0.974605	15.289433		0.002918	-0.512397	0.643792
H	-1.694581	2.814368	12.452164		0.179902	-0.122973	0.499330
C	0.504476	1.247582	1.323252		0.082830	-0.180639	-0.426072
C	0.911312	2.186038	2.385754		0.074560	-0.267343	-0.422181
C	2.060337	2.946578	2.215307		0.034346	-0.203230	-0.318286
C	2.461350	3.825160	3.199930		-0.159640	-0.194660	-0.254227
C	1.718447	3.949813	4.360759		-0.307162	-0.295259	-0.336913
C	0.570737	3.195965	4.533631		-0.238655	-0.420779	-0.438334
C	0.166542	2.317166	3.550619		-0.050443	-0.415148	-0.499078
C	4.473995	3.952145	10.413903		0.082830	0.180639	-0.426072
C	4.067158	4.890601	9.351401		0.074560	0.267343	-0.422181
C	2.918134	5.651140	9.521849		0.034346	0.203230	-0.318286
C	2.517120	6.529723	8.537225		-0.159640	0.194660	-0.254227
C	3.260024	6.654376	7.376396		-0.307162	0.295259	-0.336913
C	4.407733	5.900528	7.203525		-0.238655	0.420779	-0.438334
C	4.811928	5.021729	8.186536		-0.050443	0.415148	-0.499078
C	3.545590	4.161543	22.032977		-0.082830	0.180639	0.426072
C	3.138753	3.223087	20.970474		-0.074560	0.267343	0.422181
C	1.989729	2.462547	21.140922		-0.034346	0.203230	0.318286
C	1.588715	1.583965	20.156299		0.159640	0.194660	0.254227
C	2.331619	1.459312	18.995470		0.307162	0.295259	0.336913
C	3.479328	2.213160	18.822598		0.238655	0.420779	0.438334
C	3.883524	3.091959	19.805609		0.050443	0.415148	0.499078
C	-0.423929	1.456980	12.942325		-0.082830	-0.180639	0.426072
C	-0.017093	0.518524	14.004828		-0.074560	-0.267343	0.422181
C	1.131932	-0.242015	13.834380		-0.034346	-0.203230	0.318286
C	1.532946	-1.120598	14.819003		0.159640	-0.194660	0.254227
C	0.790042	-1.245251	15.979833		0.307162	-0.295259	0.336913
C	-0.357667	-0.491403	16.152704		0.238655	-0.420779	0.438334
C	-0.761863	0.387396	15.169693		0.050443	-0.415148	0.499078
O	1.129086	1.151197	0.272338		0.272862	-0.220937	-0.348655
O	-0.555862	0.537386	1.592833		-0.034102	0.064799	-0.546073
O	3.849385	3.855760	11.464817		0.272862	0.220937	-0.348655
O	5.534333	3.241948	10.144322		-0.034102	-0.064799	-0.546073
O	2.920980	4.257928	23.083891		-0.272862	0.220937	0.348655
O	4.605928	4.871739	21.763396		0.034102	-0.064799	0.546073
O	0.200681	1.553366	11.891411		-0.272862	-0.220937	0.348655
O	-1.484267	2.167177	13.211906		0.034102	0.064799	0.546073
				60			
Ag, (4.17 THz), IR inactive							
H	2.636038	2.841927	1.306092		0.144445	-0.157874	-0.261284
H	3.356104	4.417292	3.058800		-0.190162	-0.111268	-0.149953
H	2.033967	4.641224	5.132544		-0.466815	-0.234246	-0.329103
H	-0.015229	3.297549	5.438473		-0.350121	-0.435788	-0.518717
H	-0.732874	1.729957	3.670359		-0.023465	-0.474578	-0.655299
H	-0.766176	-0.109805	0.833090		-0.170988	-0.134932	-0.495027
H	2.342432	5.546490	10.431063		-0.144445	-0.157874	0.261284
H	1.622367	7.121854	8.678355		0.190162	-0.111268	0.149953
H	2.944504	7.345787	6.604612		0.466815	-0.234246	0.329103
H	4.993699	6.002111	6.298682		0.350121	-0.435788	0.518717
H	5.711345	4.434520	8.066796		0.023465	-0.474578	0.655299
H	5.744647	2.594757	10.904065		0.170988	-0.134932	0.495027
H	1.414028	2.567198	22.050136		-0.144445	0.157874	0.261284
H	0.693962	0.991833	20.297429		0.190162	0.111268	0.149953
H	2.016099	0.767901	18.223685		0.466815	0.234246	0.329103
H	4.065294	2.111576	17.917755		0.350121	0.435788	0.518717
H	4.782940	3.679168	19.685870		0.023465	0.474578	0.655299
H	4.816242	5.518930	22.523138		0.170988	0.134932	0.495027
H	1.707633	-0.137365	12.925166		0.144445	0.157874	-0.261284
H	2.427699	-1.712729	14.677873		-0.190162	0.111268	-0.149953
H	1.105562	-1.936662	16.751617		-0.466815	0.234246	-0.329103
H	-0.943633	-0.592986	17.057547		-0.350121	0.435788	-0.518717
H	-1.661279	0.974605	15.289433		-0.023465	0.474578	-0.655299
H	-1.694581	2.814368	12.452164		-0.170988	0.134932	-0.495027
C	0.504476	1.247582	1.323252		0.085224	-0.184523	-0.426167
C	0.911312	2.186038	2.385754		0.072525	-0.263225	-0.427383
C	2.060337	2.946578	2.215307		0.042749	-0.214419	-0.321239
C	2.461350	3.825160	3.199930		-0.151990	-0.196009	-0.265721
C	1.718447	3.949813	4.360759		-0.312100	-0.271574	-0.359165
C	0.570737	3.195965	4.533631		-0.254557	-0.380825	-0.463154
C	0.166542	2.317166	3.550619		-0.065497	-0.386596	-0.514632
C	4.473995	3.952145	10.413903		-0.085224	-0.184523	0.426167
C	4.067158	4.890601	9.351401		-0.072525	-0.263225	0.427383
C	2.918134	5.651140	9.521849		-0.042749	-0.214419	0.321239
C	2.517120	6.529723	8.537225		0.151990	-0.196009	0.265721
C	3.260024	6.654376	7.376396		0.312100	-0.271574	0.359165
C	4.407733	5.900528	7.203525		0.254557	-0.380825	0.463154
C	4.811928	5.021729	8.186536		0.065497	-0.386596	0.514632
C	3.545590	4.161543	22.032977		-0.085224	0.184523	0.426167
C	3.138753	3.223087	20.970474		-0.072525	0.263225	0.427383
C	1.989729	2.462547	21.140922		-0.042749	0.214419	0.321239
C	1.588715	1.583965	20.156299		0.151990	0.196009	0.265721
C	2.331619	1.459312	18.995470		0.312100	0.271574	0.359165
C	3.479328	2.213160	18.822598		0.254557	0.380825	0.463154
C	3.883524	3.091959	19.805609		0.065497	0.386596	0.514632
C	-0.423929	1.456980	12.942325		0.085224	0.184523	-0.426167
C	-0.017093	0.518524	14.004828		0.072525	0.263225	-0.427383
C	1.131932	-0.242015	13.834380		0.042749	0.214419	-0.321239
C	1.532946	-1.120598	14.819003		-0.151990	0.196009	-0.265721
C	0.790042	-1.245251	15.979833		-0.312100	0.271574	-0.359165
C	-0.357667	-0.491403	16.152704		-0.254557	0.380825	-0.463154
C	-0.761863	0.387396	15.169693		-0.065497	0.386596	-0.514632
O	1.129086	1.151197	0.272338		0.270763	-0.219508	-0.352285
O	-0.555862	0.537386	1.592833		-0.021949	0.050131	-0.539336
O	3.849385	3.855760	11.464817		-0.270763	-0.219508	0.352285
O	5.534333	3.241948	10.144322		0.021949	0.050131	0.539336
O	2.920980	4.257928	23.083891		-0.270763	0.219508	0.352285
O	4.605928	4.871739	21.763396		0.021949	-0.050131	0.539336
O	0.200681	1.553366	11.891411		0.270763	0.219508	-0.352285
O	-1.484267	2.167177	13.211906		-0.021949	-0.050131	-0.539336
				60			
Au, (4.22 THz), intensity=0.0427							
H	2.636038	2.841927	1.306092		0.106120	-0.019029	0.019627
H	3.356104	4.417292	3.058800		-0.131552	0.208170	-0.098425
H	2.033967	4.641224	5.132544		-0.152600	0.147427	-0.102604
H	-0.015229	3.297549	5.438473		0.055921	-0.147072	0.004227
H	-0.732874	1.729957	3.670359		0.171299	-0.221698	0.022652
H	-0.766176	-0.109805	0.833090		-0.112210	0.211526	-0.155011
H	2.342432	5.546490	10.431063		-0.106120	-0.019029	-0.019627
H	1.622367	7.121854	8.678355		0.131552	0.208170	0.098425
H	2.944504	7.345787	6.604612		0.152600	0.147427	0.102604
H	4.993699	6.002111	6.298682		-0.055921	-0.147072	-0.004227
H	5.711345	4.434520	8.066796		-0.171299	-0.221698	-0.022652
H	5.744647	2.594757	10.904065		0.112210	0.211526	0.155011
H	1.414028	2.567198	22.050136		0.106120	-0.019029	0.019627
H	0.693962	0.991833	20.297429		-0.131552	0.208170	-0.098425
H	2.016099	0.767901	18.223685		-0.152600	0.147427	-0.102604
H	4.065294	2.111576	17.917755		0.055921	-0.147072	0.004227
H	4.782940	3.679168	19.685870		0.171299	-0.221698	0.022652
H	4.816242	5.518930	22.523138		-0.112210	0.211526	-0.155011
H	1.707633	-0.137365	12.925166		-0.106120	-0.019029	-0.019627
H	2.427699	-1.712729	14.677873		0.131552	0.208170	0.098425
H	1.105562	-1.936662	16.751617		0.152600	0.147427	0.102604
H	-0.943633	-0.592986	17.057547		-0.055921	-0.147072	-0.004227
H	-1.661279	0.974605	15.289433		-0.171299	-0.221698	-0.022652
H	-1.694581	2.814368	12.452164		0.112210	0.211526	0.155011
C	0.504476	1.247582	1.323252		0.130508	-0.085180	0.001816
C	0.911312	2.186038	2.385754		0.118071	-0.092200	0.005185
C	2.060337	2.946578	2.215307		0.067473	-0.016930	-0.005984
C	2.461350	3.825160	3.199930		-0.050601	0.095845	-0.058632
C	1.718447	3.949813	4.360759		-0.064980	0.064211	-0.063821
C	0.570737	3.195965	4.533631		0.042782	-0.088440	-0.010802
C	0.166542	2.317166	3.550619		0.116282	-0.141305	0.007996
C	4.473995	3.952145	10.413903		-0.130508	-0.085180	-0.001816
C	4.067158	4.890601	9.351401		-0.118071	-0.092200	-0.005185
C	2.918134	5.651140	9.521849		-0.067473	-0.016930	0.005984
C	2.517120	6.529723	8.537225		0.050601	0.095845	0.058632
C	3.260024	6.654376	7.376396		0.064980	0.064211	0.063821
C	4.407733	5.900528	7.203525		-0.042782	-0.088440	0.010802
C	4.811928	5.021729	8.186536		-0.116282	-0.141305	-0.007996
C	3.545590	4.161543	22.032977		0.130508	-0.085180	0.001816
C	3.138753	3.223087	20.970474		0.118071	-0.092200	0.005185
C	1.989729	2.462547	21.140922		0.067473	-0.016930	-0.005984
C	1.588715	1.583965	20.156299		-0.050601	0.095845	-0.058632
C	2.331619	1.459312	18.995470		-0.064980	0.064211	-0.063821
C	3.479328	2.213160	18.822598		0.042782	-0.088440	-0.010802
C	3.883524	3.091959	19.805609		0.116282	-0.141305	0.007996
C	-0.423929	1.456980	12.942325		-0.130508	-0.085180	-0.001816
C	-0.017093	0.518524	14.004828		-0.118071	-0.092200	-0.005185
C	1.131932	-0.242015	13.834380		-0.067473	-0.016930	0.005984
C	1.532946	-1.120598	14.819003		0.050601	0.095845	0.058632
C	0.790042	-1.245251	15.979833		0.064980	0.064211	0.063821
C	-0.357667	-0.491403	16.152704		-0.042782	-0.088440	0.010802
C	-0.761863	0.387396	15.169693		-0.116282	-0.141305	-0.007996
O	1.129086	1.151197	0.272338		0.670460	-0.712176	0.380778
O	-0.555862	0.537386	1.592833		-0.492180	0.664781	-0.452046
O	3.849385	3.855760	11.464817		-0.670460	-0.712176	-0.380778
O	5.534333	3.241948	10.144322		0.492180	0.664781	0.452046
O	2.920980	4.257928	23.083891		0.670460	-0.712176	0.380778
O	4.605928	4.871739	21.763396		-0.492180	0.664781	-0.452046
O	0.200681	1.553366	11.891411		-0.670460	-0.712176	-0.380778
O	-1.484267	2.167177	13.211906		0.492180	0.664781	0.452046
