136
Compound 9
C	6.6100800	12.6195480	12.0889910
C	6.6487750	10.3836920	12.7660120
C	6.2277270	9.5864420	10.1461720
H	6.1717510	8.5591900	10.5455950
C	6.7792870	9.4568630	8.7031100
H	6.8744610	10.4537120	8.2501530
H	7.7883740	9.0305520	8.7112210
C	5.8801240	8.5954660	7.7992680
H	6.3016390	8.5429520	6.7858100
H	5.8634830	7.5641610	8.1834060
C	4.4448010	9.1353780	7.7485900
H	3.8087230	8.4866160	7.1314290
H	4.4482570	10.1233270	7.2629860
C	3.8618670	9.2695240	9.1618880
H	2.8555720	9.7103320	9.1197380
H	3.7408160	8.2640360	9.5914360
C	4.7741460	10.1134000	10.0702460
H	4.3347230	10.1826590	11.0734670
H	4.7821610	11.1370330	9.6732180
C	8.8049480	10.0046620	11.0688770
H	9.0889660	10.2905720	10.0424140
C	9.7621970	10.7718680	12.0112320
H	9.6002710	11.8567910	11.9369000
H	9.5344130	10.5162390	13.0549480
C	11.2449030	10.4648950	11.7370190
H	11.5109270	10.8380230	10.7353710
H	11.8862330	11.0037030	12.4486740
C	11.5305190	8.9573970	11.7982280
H	11.3923820	8.6070080	12.8319760
H	12.5792240	8.7573300	11.5400950
C	10.5879590	8.1757250	10.8721650
H	10.7711900	7.0972020	10.9710900
H	10.8143010	8.4358100	9.8265060
C	9.1104460	8.4908080	11.1652850
H	8.8608650	8.1169970	12.1645820
H	8.4767230	7.9263150	10.4719300
C	7.3624830	12.7246050	9.7800370
C	8.6828450	12.8251160	9.3196040
H	9.4957510	12.4282730	9.9128500
C	8.9635820	13.4468480	8.1058700
H	10.0017090	13.5032080	7.7907590
C	7.9555250	13.9925990	7.2935160
C	6.6427410	13.8826330	7.7669780
H	5.8157890	14.2769680	7.1869990
C	6.3503580	13.2585620	8.9819740
H	5.3204700	13.1669340	9.2978150
C	8.3159790	14.6636790	5.9570240
C	9.0236780	13.6369140	5.0409240
H	9.9432710	13.2514680	5.4934710
H	9.2923540	14.1021450	4.0847380
H	8.3706600	12.7821190	4.8319890
C	7.0738200	15.1934980	5.2160060
H	6.3703940	14.3894420	4.9716540
H	7.3789480	15.6617400	4.2735970
H	6.5399890	15.9502170	5.8023190
C	9.2663860	15.8560800	6.2202370
H	8.7879990	16.6052600	6.8615520
H	9.5384920	16.3416090	5.2752100
H	10.1932150	15.5392050	6.7099140
C	3.9666170	13.9945350	11.5980790
H	4.1934080	12.9253150	11.4567150
C	3.1143680	14.4250280	10.3744440
H	2.7938990	15.4680300	10.4982130
H	3.7035860	14.4020540	9.4503740
C	1.8648920	13.5446540	10.2036380
H	2.1766730	12.5116370	9.9898620
H	1.2862720	13.8818170	9.3335270
C	0.9864300	13.5598140	11.4620400
H	0.5658460	14.5677680	11.5962620
H	0.1335760	12.8796100	11.3419360
C	1.7978140	13.1834150	12.7093280
H	2.1032400	12.1294000	12.6359740
H	1.1735430	13.2661210	13.6088830
C	3.0479770	14.0667120	12.8585450
H	3.5945890	13.7773290	13.7621910
H	2.7263000	15.1029740	13.0175420
C	5.4395700	16.3948840	11.7582600
H	6.3682130	16.7308830	12.2298360
C	4.3191250	17.2113520	12.4515290
H	4.2431270	16.9331570	13.5112040
H	3.3450680	16.9789390	12.0020730
C	4.5631000	18.7254540	12.3361470
H	3.7441590	19.2755140	12.8180740
H	5.4796080	18.9873820	12.8863720
C	4.7099240	19.1653900	10.8725720
H	4.9277790	20.2397700	10.8166180
H	3.7517860	19.0140010	10.3531100
C	5.8033010	18.3606570	10.1556930
H	6.7812580	18.6079430	10.5960170
H	5.8571880	18.6508060	9.0979320
C	5.5643840	16.8456640	10.2711990
H	6.3781740	16.3036520	9.7743980
H	4.6481270	16.5899850	9.7246870
C	7.8144660	14.5810150	12.8137750
H	8.3981830	13.6882450	13.0622190
C	7.6273100	15.3536490	14.1297980
H	8.6147830	15.5735950	14.5517860
H	7.0725310	14.7745530	14.8707830
H	7.1124840	16.3063570	13.9879020
C	8.6596060	15.3806890	11.8103220
H	8.7966460	14.8361080	10.8753620
H	9.6487940	15.5592920	12.2486840
H	8.2216720	16.3543130	11.5788040
C	5.8899980	12.1992860	14.4598480
H	5.6720240	13.2596500	14.3305840
C	4.5898450	11.5111150	14.9054740
H	3.8562190	11.4795610	14.0954180
H	4.1555240	12.0853750	15.7329310
H	4.7752920	10.4918640	15.2418940
C	6.9880160	12.0574680	15.5238620
H	7.1984930	11.0056970	15.7179920
H	6.6506270	12.5244320	16.4568720
H	7.9178050	12.5467350	15.2164580
C	6.5934150	8.1468050	13.7243410
C	7.7004130	7.5707970	14.4025750
C	7.8041390	6.1802510	14.4844580
H	8.6700640	5.7510200	14.9838400
C	6.8154850	5.3449070	13.9683400
C	5.6819660	5.9192150	13.4046500
H	4.8700950	5.2846410	13.0548570
C	5.5385500	7.3076620	13.2911900
B	7.2035560	10.3974870	11.2061910
B	5.3405300	14.7929570	11.8636330
N	7.0572710	12.0275740	10.9973050
N	6.3557000	11.7606460	13.1187940
N	6.4562190	9.5469010	13.7166710
N	6.5138280	14.0337420	12.2446770
H	6.9102010	4.2650420	14.0426460
C	8.7309990	8.4315750	15.0909500
H	8.2628220	9.0699980	15.8506700
H	9.4784030	7.8086410	15.5931470
H	9.2604030	9.0963520	14.4027500
C	4.2336320	7.8644700	12.7751220
H	4.0003630	8.8291600	13.2355870
H	4.2441860	8.0161780	11.6920800
H	3.4131950	7.1731990	12.9970580
134
Compound 10
C	6.5957810	12.6419920	12.1123880
C	6.6423960	10.4160690	12.7809730
C	6.1710640	9.5725760	10.2084300
H	6.2628670	8.5322590	10.5598840
C	6.5802600	9.5482230	8.7150940
H	6.5004680	10.5553120	8.2848430
H	7.6320050	9.2570450	8.6086210
C	5.7015380	8.5950150	7.8858510
H	6.0072000	8.6162160	6.8304920
H	5.8576660	7.5630680	8.2349450
C	4.2125760	8.9478140	8.0115220
H	3.5975960	8.2326200	7.4487620
H	4.0371090	9.9349280	7.5563830
C	3.7748810	8.9881910	9.4825650
H	2.7221990	9.2953800	9.5584010
H	3.8329960	7.9717670	9.9007860
C	4.6690640	9.9242670	10.3142380
H	4.3425050	9.9035450	11.3635350
H	4.5051380	10.9571560	9.9694280
C	8.7659670	10.0188440	11.0800310
H	9.0872420	10.4090440	10.0991620
C	9.6840690	10.6714670	12.1404570
H	9.5215820	11.7592380	12.1828820
H	9.4114560	10.2890890	13.1356440
C	11.1774690	10.3936670	11.8980620
H	11.4862540	10.8673880	10.9528650
H	11.7867500	10.8532190	12.6891890
C	11.4590790	8.8868100	11.8166960
H	11.2703710	8.4335390	12.8015440
H	12.5182070	8.7067430	11.5875880
C	10.5573750	8.2121320	10.7734910
H	10.7354840	7.1280340	10.7655820
H	10.8290220	8.5795510	9.7716930
C	9.0685590	8.5013380	11.0351110
H	8.7811520	8.0347330	11.9849560
H	8.4668220	8.0104130	10.2622720
C	7.3411850	12.7431510	9.8036930
C	8.6753970	12.9471050	9.4291750
H	9.4746050	12.6241510	10.0856460
C	8.9816810	13.5702140	8.2219130
H	10.0291340	13.7118680	7.9710980
C	7.9844340	14.0100890	7.3351180
C	6.6566350	13.7868540	7.7206080
H	5.8403460	14.0913910	7.0751980
C	6.3389730	13.1597990	8.9278500
H	5.3033340	12.9672080	9.1768460
C	8.3729550	14.6918270	6.0115440
C	9.2308140	13.7212670	5.1651550
H	10.1488140	13.4279420	5.6850170
H	9.5204750	14.1956410	4.2196420
H	8.6733220	12.8074780	4.9307730
C	7.1415150	15.0958680	5.1789900
H	6.5320650	14.2277250	4.9035090
H	7.4668450	15.5777630	4.2503060
H	6.5026200	15.8080970	5.7136460
C	9.1917830	15.9697060	6.3131040
H	8.6051970	16.6808160	6.9061640
H	9.4824570	16.4649480	5.3786930
H	10.1080630	15.7458510	6.8695000
C	3.9902340	14.0267940	11.5326030
H	4.2185420	12.9575280	11.3956060
C	3.1773740	14.4617880	10.2851860
H	2.8583670	15.5064260	10.3980660
H	3.7973580	14.4341810	9.3818430
C	1.9285100	13.5881730	10.0785850
H	2.2398730	12.5532990	9.8728460
H	1.3755810	13.9288340	9.1932040
C	1.0157470	13.6065080	11.3125350
H	0.5983480	14.6170550	11.4371940
H	0.1619420	12.9323990	11.1672090
C	1.7891050	13.2218260	12.5814780
H	2.0907730	12.1663100	12.5141500
H	1.1396980	13.3058000	13.4629610
C	3.0399200	14.0968600	12.7690630
H	3.5626460	13.7961550	13.6835930
H	2.7211110	15.1342710	12.9279840
C	5.4682010	16.4201570	11.7334740
H	6.3768870	16.7552020	12.2433040
C	4.3231550	17.2498430	12.3677100
H	4.2021150	16.9858690	13.4268620
H	3.3674960	17.0151600	11.8816320
C	4.5787750	18.7613420	12.2432600
H	3.7421060	19.3211520	12.6815550
H	5.4715550	19.0268320	12.8296210
C	4.7919230	19.1815390	10.7819740
H	5.0158930	20.2544620	10.7218840
H	3.8572480	19.0262360	10.2224560
C	5.9131970	18.3642830	10.1246780
H	6.8714420	18.6137760	10.6052500
H	6.0154210	18.6410380	9.0668520
C	5.6628590	16.8518210	10.2481550
H	6.4960080	16.3001400	9.7956160
H	4.7714800	16.5922160	9.6638280
C	7.7829090	14.5948990	12.9020530
H	8.3527960	13.6990700	13.1705320
C	7.5392100	15.3627480	14.2115350
H	8.5081360	15.5995560	14.6661470
H	6.9700600	14.7749130	14.9343610
H	7.0132110	16.3064820	14.0510500
C	8.6739420	15.4007930	11.9439900
H	8.8273060	14.8772300	10.9998190
H	9.6527900	15.5485900	12.4157400
H	8.2629560	16.3887180	11.7237080
C	5.8584210	12.1987900	14.4806750
H	5.6408720	13.2616090	14.3687980
C	4.5489430	11.4961740	14.8737690
H	3.8265440	11.5124110	14.0528730
H	4.1069370	12.0276860	15.7251830
H	4.7265140	10.4589950	15.1558190
C	6.9339810	12.0296100	15.5644060
H	7.1516130	10.9724660	15.7217060
H	6.5708300	12.4590520	16.5057060
H	7.8640320	12.5408030	15.2950380
C	6.6504700	8.1804730	13.6351450
C	7.6360250	7.5463430	14.4052430
H	8.3169890	8.1579170	14.9905840
C	7.7690070	6.1561320	14.4228540
H	8.5584860	5.7100670	15.0175500
C	6.8804030	5.3618690	13.6901560
C	5.8636450	5.9796430	12.9514950
H	5.1673170	5.3530380	12.4021740
C	5.7483420	7.3645250	12.9267100
H	4.9395670	7.8260250	12.3704310
C	7.9201210	3.3242730	14.3740940
H	8.9253980	3.6092800	14.0337910
H	7.7694460	2.2577870	14.1937640
H	7.8397720	3.5223560	15.4521370
B	7.1626860	10.4139880	11.2213440
B	5.3557610	14.8203100	11.8428360
N	7.0171930	12.0442180	11.0131120
N	6.3515190	11.7833480	13.1429580
N	6.4958030	9.5732180	13.7344980
N	6.5083500	14.0552060	12.2712050
O	6.9099890	3.9916620	13.6412370
103
Compound 11
B	8.1751970	4.1518420	3.9568130
B	4.7022300	1.2617460	2.9153280
C	5.9027160	3.2990260	3.5109650
C	4.2573180	2.5896990	2.0294090
C	5.6234080	4.7512460	1.4825800
H	6.4825090	5.2107610	1.9747140
C	6.0627930	4.3208370	0.0770770
H	6.8877910	3.6033600	0.1239260
H	6.4064050	5.2008560	-0.4788230
H	5.2351540	3.8667320	-0.4686770
C	4.4912480	5.7904360	1.4375170
H	3.6555860	5.4328360	0.8365390
H	4.8756650	6.7197920	0.9994520
H	4.1172030	6.0189630	2.4410230
C	6.0327290	5.2433470	5.0128410
H	4.9684730	5.0207090	4.8738180
C	6.3366580	5.1023620	6.5115500
H	6.1574070	4.0887250	6.8694330
H	5.6844210	5.7827550	7.0718120
H	7.3704320	5.3727080	6.7406220
C	6.2645800	6.6864870	4.5418930
H	7.3017610	6.9972700	4.6917350
H	5.6287000	7.3631190	5.1242870
H	6.0152850	6.8201990	3.4871610
C	9.2768700	5.0417680	4.6790730
H	8.8836950	5.7395970	5.4251130
C	10.0029710	5.9079080	3.6078280
H	9.2980250	6.6843570	3.2752120
H	10.8417790	6.4465680	4.0728820
C	10.5108690	5.1481090	2.3646500
H	11.4636710	4.6607470	2.5893130
H	10.7361810	5.8742290	1.5719860
C	10.2100700	4.0595790	5.4490360
H	9.6151010	3.5861970	6.2443200
H	10.9990620	4.6280790	5.9629870
C	10.8631530	2.9581840	4.5897800
H	11.7110290	3.3815800	4.0438080
H	11.2990520	2.2008550	5.2551900
C	9.9003440	2.2608480	3.6026140
H	9.3463400	1.4821130	4.1425190
H	10.4880400	1.7230070	2.8444910
C	8.8650220	3.1838640	2.8988300
H	8.1605380	2.5271370	2.3721050
C	9.5138510	4.1068260	1.8203250
H	10.0150670	3.4862560	1.0633300
H	8.7120140	4.6359870	1.2865950
C	5.6937240	1.8575870	5.4234540
C	4.5686610	2.0204250	6.2421250
H	3.6363850	2.3609300	5.8024210
C	4.6418410	1.7404450	7.6048390
H	3.7564320	1.8727350	8.2225360
C	5.8339660	1.2939270	8.1924950
C	6.9519290	1.1424090	7.3634710
H	7.8918220	0.7997420	7.7900820
C	6.8862690	1.4133290	5.9960150
H	7.7602690	1.2720040	5.3725120
C	5.8994060	0.9591380	9.6641150
H	5.5765180	-0.0737960	9.8499500
H	5.2475040	1.6125830	10.2539120
H	6.9183760	1.0564240	10.0528430
C	3.6761900	0.1388650	3.5096130
H	2.9047890	0.5648240	4.1707250
C	2.9155920	-0.5406840	2.3386250
H	2.2636810	-1.3322220	2.7400030
H	2.2451170	0.1898100	1.8800810
C	3.8055690	-1.1534210	1.2352490
H	4.1577320	-2.1408640	1.5491830
H	3.1877350	-1.3367650	0.3453740
C	5.0131210	-0.2806990	0.8305840
H	4.6576830	0.5145920	0.1657700
H	5.7061870	-0.8884750	0.2275110
C	5.7735100	0.3915010	1.9966820
H	6.5308350	1.0486130	1.5380750
C	6.5445900	-0.6121030	2.8851840
H	7.1834070	-0.0401370	3.5711350
H	7.2353050	-1.2064100	2.2660270
C	5.6650370	-1.5770110	3.7077200
H	6.2802240	-2.0403220	4.4922540
H	5.3471850	-2.4054980	3.0678210
C	4.4278320	-0.9227050	4.3651020
H	4.7375330	-0.4691890	5.3109860
H	3.7210240	-1.7200810	4.6429780
C	2.1815820	2.4461470	0.8018290
C	1.9407590	2.0446490	-0.5343980
C	0.6646930	1.5963630	-0.8872500
H	0.4912790	1.2659390	-1.9090770
C	-0.3833020	1.5914980	0.0305090
H	-1.3707730	1.2462170	-0.2632100
C	-0.1576000	2.0696610	1.3190230
H	-0.9779830	2.1112680	2.0323470
C	1.1068390	2.5070500	1.7249030
C	1.2934420	3.0746590	3.1128770
H	0.3233630	3.2232770	3.5982070
H	1.8091660	4.0423650	3.0801280
H	1.8876700	2.4154510	3.7549600
C	3.0204300	2.1464290	-1.5842020
H	3.8908010	1.5193180	-1.3648420
H	3.3869290	3.1778670	-1.6640160
H	2.6344760	1.8493680	-2.5647180
N	5.5605030	2.1276850	4.0208390
N	5.3048060	3.5733720	2.3260950
N	3.4312860	2.9855030	1.1378970
N	6.7602440	4.2298020	4.1586650
103
Compound 11_forced
B	8.1516450	4.1531140	3.8983710
B	4.4160790	1.2836510	3.2946970
C	5.8513520	3.2577610	3.6828740
C	4.3546660	2.4343440	2.0635720
C	5.4572100	4.7725450	1.7261500
H	6.2492070	5.2880890	2.2700560
C	5.9508310	4.5669290	0.2839630
H	6.6840980	3.7588470	0.2220920
H	6.4330100	5.4916220	-0.0569030
H	5.1286790	4.3317150	-0.3902630
C	4.2032330	5.6591590	1.7618360
H	3.4042570	5.2215420	1.1629530
H	4.4457940	6.6468110	1.3516430
H	3.8331620	5.7955480	2.7834940
C	6.1511820	5.0779400	5.3154300
H	5.1189860	4.7287480	5.4188770
C	6.8060360	4.9764160	6.7034160
H	7.0414830	3.9458680	6.9686030
H	6.1095830	5.3685080	7.4534300
H	7.7204240	5.5705010	6.7678400
C	6.1005850	6.5397270	4.8481590
H	7.1051210	6.9367900	4.6755350
H	5.6296620	7.1520400	5.6260370
H	5.5197680	6.6622810	3.9318290
C	9.2830770	5.1042870	4.4875710
H	8.9346460	5.8171300	5.2398640
C	9.8664140	5.9609920	3.3252010
H	9.0895650	6.6769180	3.0158860
H	10.7004050	6.5715570	3.7014980
C	10.3286820	5.1753290	2.0827440
H	11.3168700	4.7433940	2.2624690
H	10.4664000	5.8769960	1.2490320
C	10.3281140	4.1910770	5.1949160
H	9.8396590	3.7395480	6.0707990
H	11.1483770	4.8070340	5.5920360
C	10.9189430	3.0660050	4.3210320
H	11.6988320	3.4773140	3.6743120
H	11.4339820	2.3458160	4.9709730
C	9.8763770	2.3085840	3.4697190
H	9.3786760	1.5724240	4.1120220
H	10.3964000	1.7234100	2.6974170
C	8.7777810	3.1875390	2.7990620
H	8.0515870	2.4982850	2.3465350
C	9.3438150	4.0729810	1.6473240
H	9.8265310	3.4301940	0.8967110
H	8.5019400	4.5504870	1.1324980
C	5.8812330	1.7990160	5.5562100
C	5.0458840	2.1575400	6.6192560
H	4.1034280	2.6547080	6.4113540
C	5.4105240	1.8716410	7.9343820
H	4.7427570	2.1567100	8.7440390
C	6.6190290	1.2277820	8.2297110
C	7.4526970	0.8839280	7.1577000
H	8.3991330	0.3851680	7.3529530
C	7.0886600	1.1587680	5.8391640
H	7.7369350	0.8646140	5.0224460
C	6.9963170	0.8889860	9.6525880
H	6.6204670	-0.1031970	9.9354240
H	6.5755240	1.6093400	10.3620420
H	8.0829880	0.8747740	9.7872930
C	3.0043460	0.8869230	4.0490670
H	2.5030830	1.7700860	4.4824490
C	2.0315650	0.2964220	2.9981160
H	1.0813270	0.0318330	3.4883240
H	1.7840730	1.0630560	2.2639990
C	2.5578740	-0.9414580	2.2431180
H	2.4278830	-1.8332900	2.8635990
H	1.9278360	-1.1073520	1.3590780
C	4.0282800	-0.8243910	1.7832050
H	4.0403510	-0.2464840	0.8588600
H	4.3936980	-1.8277580	1.5116670
C	5.0115690	-0.1747260	2.7903970
H	5.9714420	-0.0509640	2.2605580
C	5.2834230	-1.1220430	3.9840830
H	6.1130350	-0.7291750	4.5790170
H	5.6328000	-2.0950430	3.6033950
C	4.0736320	-1.3721800	4.9118110
H	4.4343240	-1.7860020	5.8640980
H	3.4513610	-2.1596820	4.4775300
C	3.1987780	-0.1291440	5.2120380
H	3.6196420	0.3831150	6.0788070
H	2.2066740	-0.4788980	5.5389250
C	2.9120570	2.0463750	0.0923550
C	3.4080380	1.2849310	-0.9967170
C	2.4992820	0.7298350	-1.9020920
H	2.8838740	0.1271830	-2.7221510
C	1.1279200	0.9463210	-1.7840720
H	0.4365090	0.5027170	-2.4950910
C	0.6595170	1.7660300	-0.7599660
H	-0.4045630	1.9783540	-0.6800350
C	1.5282800	2.3436390	0.1710000
C	0.9949620	3.3245320	1.1898400
H	-0.0990770	3.2945730	1.2181210
H	1.2894470	4.3518840	0.9353850
H	1.3626610	3.1320110	2.2022110
C	4.8941320	1.1284860	-1.2242400
H	5.4210430	0.7307560	-0.3507380
H	5.3575850	2.0956150	-1.4572080
H	5.0853330	0.4548740	-2.0657630
N	5.4858290	2.0941070	4.2004210
N	5.2601960	3.5101770	2.4861360
N	3.8131610	2.6941800	0.9370550
N	6.7702120	4.1611750	4.2833510
101
Compound 12
B	8.2208920	4.1321160	3.9735520
B	4.6192510	1.3961910	2.9314210
C	5.9114930	3.3682830	3.5559800
C	4.2282860	2.7543670	2.0805170
C	5.6368570	4.8861040	1.5705650
H	6.5214380	5.3076420	2.0518180
C	6.0228790	4.4908220	0.1385310
H	6.8179890	3.7388050	0.1374450
H	6.3899070	5.3770710	-0.3920190
H	5.1619630	4.0922300	-0.3997990
C	4.5281380	5.9510850	1.5910160
H	3.6647870	5.6245470	1.0115340
H	4.9168060	6.8822830	1.1608870
H	4.1948060	6.1628630	2.6123190
C	6.1409810	5.2627830	5.1088300
H	5.0671560	5.0746940	4.9945580
C	6.4814050	5.0734250	6.5943850
H	6.2828020	4.0559500	6.9305690
H	5.8644540	5.7565380	7.1901930
H	7.5283400	5.3084990	6.8016610
C	6.4021330	6.7106640	4.6686300
H	7.4518430	6.9872850	4.7961640
H	5.8032160	7.3896050	5.2864840
H	6.1272960	6.8794980	3.6254400
C	9.3653460	4.9766610	4.6840300
H	9.0107370	5.6742750	5.4493310
C	10.0902030	5.8382390	3.6080270
H	9.3997470	6.6389290	3.3036080
H	10.9544900	6.3463700	4.0607000
C	10.5476270	5.0835450	2.3422650
H	11.4910270	4.5661850	2.5377690
H	10.7755970	5.8152420	1.5554860
C	10.2879790	3.9569940	5.4164900
H	9.6991860	3.4889750	6.2195190
H	11.1057760	4.4945690	5.9186170
C	10.8867380	2.8502330	4.5254720
H	11.7330690	3.2566480	3.9644000
H	11.3161350	2.0702720	5.1686260
C	9.8791450	2.1966880	3.5533080
H	9.3138610	1.4291750	4.0975980
H	10.4312230	1.6502620	2.7748060
C	8.8570140	3.1605770	2.8854470
H	8.1212010	2.5330800	2.3660890
C	9.5093690	4.0791260	1.8055980
H	9.9762470	3.4551310	1.0296690
H	8.7118930	4.6382630	1.2965770
C	5.6851000	1.8869430	5.4346190
C	4.5855060	2.0714210	6.2829190
H	3.6573700	2.4565830	5.8723170
C	4.6778550	1.7520510	7.6357260
H	3.8121490	1.9012550	8.2770620
C	5.8641460	1.2434570	8.1835670
C	6.9564060	1.0700610	7.3251340
H	7.8908150	0.6785440	7.7206480
C	6.8712000	1.3803110	5.9671480
H	7.7236950	1.2201720	5.3188360
C	5.9485840	0.8664940	9.6440270
H	5.5788820	-0.1537870	9.8116680
H	5.3448200	1.5352990	10.2669950
H	6.9803120	0.9028610	10.0088120
C	3.5602940	0.2970630	3.5100720
H	2.8100720	0.7428120	4.1835990
C	2.7635140	-0.3434060	2.3398140
H	2.1236520	-1.1461950	2.7387060
H	2.0795770	0.4018170	1.9312320
C	3.6067080	-0.9234420	1.1808100
H	3.9415060	-1.9342030	1.4344440
H	2.9571670	-1.0460680	0.3031540
C	4.8272820	-0.0670360	0.7796000
H	4.4813730	0.7691050	0.1581030
H	5.4852420	-0.6685260	0.1323690
C	5.6375990	0.5182880	1.9595650
H	6.4170650	1.1595390	1.5159270
C	6.3765510	-0.5530820	2.7961090
H	7.0614750	-0.0350990	3.4809530
H	7.0201980	-1.1620480	2.1413030
C	5.4734830	-1.4984090	3.6171000
H	6.0882860	-2.0149030	4.3681150
H	5.0948870	-2.2903570	2.9642680
C	4.2899540	-0.8054660	4.3303480
H	4.6505060	-0.3824820	5.2720720
H	3.5598770	-1.5777560	4.6187610
C	2.1813660	2.6446550	0.8424520
C	1.9105410	2.2009580	-0.4583260
C	0.6318650	1.7784450	-0.8303700
H	0.4694380	1.4222560	-1.8415650
C	-0.4184630	1.8321990	0.0920830
C	-0.1691600	2.3104860	1.3855100
H	-0.9945850	2.3577660	2.0895500
C	1.1086450	2.7101690	1.7538250
N	5.5322940	2.1982540	4.0431650
N	5.3059760	3.6928470	2.3878590
N	3.4365070	3.1742230	1.1687030
N	6.8143320	4.2509170	4.2095550
H	1.2935080	3.0830490	2.7571660
H	2.7169940	2.1760960	-1.1854280
O	-1.7114120	1.4577520	-0.1685400
C	-2.0101670	0.9608720	-1.4599540
H	-1.4331750	0.0545770	-1.6902770
H	-3.0743490	0.7160640	-1.4503120
H	-1.8200260	1.7120170	-2.2392940