15
Conformer name: N1 Relative energy: 0 kcal/mol
C   0.7641964870   0.2453435109  -0.2655914673
C   0.0259394585  -0.0396359497   1.0498453735
N   0.2404348560   1.5870911596  -0.7080730641
H   0.9360019274   2.1555085113  -1.2014396468
H  -0.5681635211   1.4061301040  -1.3289564331
H   1.8429935747   0.3249933174  -0.0637989957
C   0.4685271508  -0.7757430263  -1.3641038932
H   0.6620866191  -1.7854065110  -0.9734855921
H   1.1080319531  -0.5931675104  -2.2446200362
O  -0.9149955903  -0.5530060026  -1.6600388770
O  -0.6183652996   0.8256064468   1.6217437091
H  -1.2215246931  -1.1830501192  -2.3292437805
O   0.2256107120  -1.2958992795   1.4525889314
H  -0.2296562716  -1.4252840219   2.3079827023
H  -0.1112557388   2.0814394066   0.1333152817
15
Conformer name: N2 Relative energy: 0.59 kcal/mol
C   0.4783482068   0.0329782353  -0.2368507968
C   0.0164550958  -0.0361691977   1.2162360961
N   0.3228962740   1.4655231372  -0.6686350958
H   0.1348839507   1.4727505947  -1.6861179714
H  -0.4586768147   1.8824746804  -0.1339173245
H   1.5340130536  -0.2496665264  -0.3486890903
C  -0.4059241130  -0.8262994369  -1.1522206791
H  -1.4732508474  -0.6744199468  -0.9106248778
H  -0.1426667733  -1.8842343622  -1.0037462605
O  -0.0952843214  -0.3579002766  -2.4676555878
O  -0.5824248397   0.8885104355   1.7431338284
H  -0.5903186645  -0.8659159766  -3.1279757865
O   0.3193324046  -1.2198992905   1.7554258595
H  -0.0216574371  -1.2462238108   2.6716705856
H   1.1601164253   2.0256583809  -0.4733481626
15
Conformer name: N3 Relative energy: 3.35 kcal/mol
C   0.7582862683   0.2593112000  -0.2594206407
C   0.0925276126  -0.2365330119   1.0312131356
N   0.1875554325   1.6040550973  -0.6490035769
H  -0.7249550840   1.4208507782  -1.1029796248
H   0.0364353632   2.1987495597   0.1762603181
H   1.8359897238   0.3789896497  -0.0720229242
C   0.4815495154  -0.7068955421  -1.4109170566
H   0.6922911560  -1.7279155627  -1.0604718128
H   1.1133580781  -0.4720187557  -2.2844313961
O  -0.9073672991  -0.4926643020  -1.6920433629
O   0.1605723696  -1.3855153681   1.3980964860
H  -1.2355299894  -1.1616157075  -2.3107692697
O  -0.5190317893   0.7878356063   1.6858478612
H  -0.8974207670   0.4378336062   2.5161386860
H   0.7894695679   2.0942295751  -1.3210341517
15
Conformer name: N4 Relative energy: 4.14 kcal/mol
C   0.4488813058   0.0527902145  -0.2411988060
C   0.0837157733  -0.2304007755   1.2115217964
N   0.1997280783   1.4930454071  -0.6201280862
H   0.2334386349   1.5443024732  -1.6531229695
H  -0.7261687365   1.8032230277  -0.2974256800
H   1.5217586558  -0.1339283345  -0.3950522271
C  -0.3694873990  -0.8180587937  -1.2003520553
H  -1.4485507215  -0.7361538483  -0.9763467943
H  -0.0505643275  -1.8634381425  -1.0764808528
O  -0.0579933939  -0.2851067206  -2.4908492517
O   0.2035798707  -1.3262231020   1.7078587231
H  -0.4648024592  -0.8257770979  -3.1841546083
O  -0.4004137259   0.8892835697   1.8170795575
H  -0.6328411149   0.6600306648   2.7387828674
H   0.8935247051   2.1299228305  -0.2120332631
15
Conformer name: N5 Relative energy: 8.89 kcal/mol
C   0.4928790548   0.0063890536  -0.2435824441
C   0.0128011421  -0.0355611628   1.2162980990
N   0.3762043112   1.4428142826  -0.6727382601
H   0.1651744265   1.4654212178  -1.6848202544
H  -0.3838349328   1.8656923630  -0.1058416167
H   1.5399561398  -0.3044048967  -0.3734039060
C  -0.4334737215  -0.8148967422  -1.1543617019
H  -1.4899178566  -0.5986328148  -0.9146218391
H  -0.2394384400  -1.8883182285  -0.9999346711
O  -0.0912632484  -0.3840699191  -2.4728524342
O  -0.6427627980   0.8921426821   1.6574866055
H  -0.6306885750  -0.8530062517  -3.1278346389
O   0.2834611543  -1.1321556289   1.9334369065
H   0.8696643949  -1.7507466805   1.4649971945
H   1.2327543405   1.9786683555  -0.4929120988
15
Conformer name: N6 Relative energy: 9.02 kcal/mol
C   0.5295944436   0.5606082420  -0.2027769025
C  -0.0017156416  -0.4214251109   0.8481852356
N   0.3106562151   1.9188765443   0.4182883997
H   0.1896290708   2.6614151581  -0.2815401030
H  -0.5448989892   1.8312324760   1.0035863541
H   1.5978103053   0.4135573819  -0.4093703402
C  -0.3114629514   0.4852873538  -1.4884369733
H   0.0884769630   1.2109761675  -2.2219258058
H  -1.3595015459   0.7520334903  -1.2469981849
O  -0.1865075766  -0.8510309703  -1.9279019347
O  -0.8905112472  -0.0697088853   1.6150785846
H  -0.6482377722  -0.9572046913  -2.7731726456
O   0.6049992341  -1.5998510573   0.7962488726
H   0.1890806287  -2.1965661783   1.4503239764
H   1.0842949427   2.1879821578   1.0386722838
15
Conformer name: N7 Relative energy: 9.25 kcal/mol
C   0.7739092064   0.2113660167  -0.2730009547
C   0.0191963627  -0.0358553180   1.0554505603
N   0.2851578339   1.5641506235  -0.7190085209
H   1.0121888727   2.1524299251  -1.1375410579
H  -0.4837334263   1.4119900998  -1.3940397890
H   1.8557459457   0.2672519996  -0.0748337388
C   0.4564426624  -0.7987151059  -1.3797944438
H   0.6385623060  -1.8256339440  -1.0213299171
H   1.1039176451  -0.6212525244  -2.2560627345
O  -0.9189812232  -0.5600013169  -1.6733682946
O  -0.6479741726   0.8586899399   1.5453938707
H  -1.2267407394  -1.1579798069  -2.3714938223
O   0.1577893364  -1.2263265606   1.6452635029
H   0.7452070932  -1.8246271667   1.1547014492
H  -0.1296929975   2.0128957428   0.1259092624
15
Conformer name: N8 Relative energy: 9.47 kcal/mol
C  -0.5927238331   0.3620074938  -0.1102883908
C   0.5234963975   0.0494547597   0.8881273022
N  -1.8686408251   0.0670771153   0.6461576333
H  -2.2150054568  -0.8807560501   0.4467887493
H  -1.6365700995   0.1005024136   1.6595730145
H  -0.5801974825   1.4356769177  -0.3526745035
C  -0.5252093921  -0.4468669895  -1.4278352322
H  -1.5104357959  -0.3927484413  -1.9204574351
H  -0.3041575088  -1.5081125275  -1.2082004422
O   0.3946022497   0.1360182700  -2.3185394880
O   0.2877589837  -0.1759027747   2.0664764386
H   1.2953270627  -0.1105117482  -2.0593530270
O   1.7251736181   0.0550983058   0.3019246810
H   2.4050403014  -0.1281324849   0.9812763344
H  -2.6188331748   0.7323561875   0.4279401582
15
Conformer name: N9 Relative energy: 9.84 kcal/mol
C  -0.5609078984   0.3333483681  -0.1563577764
C   0.5005339457   0.0386464797   0.9114923611
N  -1.8729948998   0.0870043263   0.5503617381
H  -2.2538904243  -0.8434474856   0.3373009984
H  -1.6567868910   0.1063805591   1.5707964243
H  -0.5142671342   1.3990277385  -0.4296285717
C  -0.4533195568  -0.5000457686  -1.4448752693
H  -1.4542402588  -0.5560750365  -1.9168594206
H  -0.1145269271  -1.5256357482  -1.2100048390
O   0.4640115282   0.2084029537  -2.2530686027
O   0.1765191205  -0.1575406488   2.0778064612
H   0.7266527659  -0.3414481419  -3.0061343746
O   1.7308695754   0.0386560062   0.4125609935
H   2.3611443920  -0.1284073337   1.1418794783
H  -2.5870021065   0.7855088207   0.3171072694
15
Conformer name: N10 Relative energy: 9.88 kcal/mol
C  -0.6503773250   0.3779620260  -0.0520199202
C   0.6203421770   0.0378038654   0.7685847962
N  -1.7790269164   0.0606022141   0.8912884503
H  -2.4822592342   0.8043499026   0.9516412258
H  -2.2552559636  -0.8201921013   0.6614161474
H  -0.6631075278   1.4602018199  -0.2537825462
C  -0.7666204168  -0.3867659852  -1.3761085558
H  -1.7305950256  -0.1626544530  -1.8643526154
H  -0.6846354597  -1.4754559439  -1.2020536046
O   0.3314002926   0.1103791294  -2.1454949086
O   0.4949131565  -0.2004696425   1.9646196896
H   0.3763155518  -0.3479302811  -2.9992006440
O   1.7766785116   0.0429460043   0.1304061865
H   1.6199034961   0.1665584951  -0.8345438547
H  -1.2833514086  -0.0642597949   1.8156972497
15
Conformer name: N11 Relative energy: 10.04 kcal/mol
C   0.5556153626   0.5832643807  -0.1569683670
C   0.0089985144  -0.4480438957   0.8341964480
N   0.2739536127   1.9140677948   0.5000912793
H   1.0244651003   2.2013769795   1.1402018829
H   0.1255349549   2.6703372530  -0.1797315413
H   1.6370668084   0.4736120413  -0.3142508517
C  -0.2485086217   0.5284732582  -1.4825300242
H   0.1884475588   1.2433377253  -2.2027237336
H  -1.2867642569   0.8354703701  -1.2654476659
O  -0.3128920281  -0.7867120525  -1.9791579486
O  -0.9007924839  -0.1434524870   1.5960284226
H   0.4521605129  -0.9717484842  -2.5434855034
O   0.6262288658  -1.6196416002   0.7359201016
H   0.1964700450  -2.2544268985   1.3435419660
H  -0.5862729410   1.7686356714   1.0687589333
15
Conformer name: N12 Relative energy: 10.61 kcal/mol
C   0.7886437245   0.1712435510  -0.2418748937
C   0.0080217327  -0.0037472275   1.0758424749
N   0.3640953019   1.5203792003  -0.7538093295
H   1.1100629844   2.0385788482  -1.2285818887
H  -0.4268248381   1.3569445562  -1.4046584693
H   1.8722716472   0.1831437882  -0.0435574588
C   0.4167642287  -0.8638364552  -1.3281312810
H   0.4801343756  -1.8870221077  -0.9288955603
H   1.1195887405  -0.7827883598  -2.1714762771
O  -0.8825172018  -0.5383571398  -1.8187002515
O  -0.7230044936   0.8833531033   1.4797747689
H  -1.5521137908  -1.1404173072  -1.4611339332
O   0.1599271743  -1.1589705859   1.7378326459
H   0.8398553138  -1.7322068239   1.3452501760
H  -0.0158186907   2.0543993414   0.0515410825
15
Conformer name: N13 Relative energy: 12.12 kcal/mol
C  -0.6050174886   0.3228823593  -0.1172630878
C   0.6067770423   0.0324848004   0.7691089728
N  -1.8684796127  -0.0944229596   0.6113597532
H  -2.7064292048   0.2367055599   0.1157385613
H  -1.9343658820  -1.1187211374   0.6901595683
H  -0.6755607945   1.4104635574  -0.2777108142
C  -0.4983931990  -0.3872745825  -1.4819506058
H  -1.4669944497  -0.3160046530  -2.0047893042
H  -0.2579800459  -1.4559843252  -1.3301769930
O   0.4446428981   0.2772357176  -2.2873884069
O   1.7063080562  -0.2207065902   0.3284346610
H   1.3340185601   0.0446606818  -1.9744873046
O   0.2678242640   0.1102370559   2.0840470805
H   1.0702577379  -0.0401554109   2.6222923539
H  -1.8739010616   0.2842519609   1.5694912755
15
Conformer name: N14 Relative energy: 13.26 kcal/mol
C   0.5449671631   0.5295066818  -0.2769770848
C   0.1095530376  -0.4006376068   0.8589420374
N   0.3107481556   1.9610601513   0.1603823583
H   0.4431221557   2.6230086393  -0.6160791824
H  -0.6513118226   2.0533822122   0.5205628635
H   1.6188765549   0.3932753748  -0.4605594739
C  -0.2835894517   0.2671526864  -1.5438762146
H   0.1222859268   0.8691976796  -2.3787979368
H  -1.3362240954   0.5587154996  -1.3629496575
O  -0.1430097094  -1.1226889307  -1.7588499988
O   0.7318486129  -1.3622478794   1.2367040416
H  -0.5852958093  -1.3720030065  -2.5841463421
O  -1.0877877222   0.0433772678   1.3506189893
H  -1.3813693891  -0.5748571712   2.0478450494
H   0.9514910893   2.2342968879   0.9172418915
15
Conformer name: N15 Relative energy: 13.97 kcal/mol
C   0.5718465070   0.5698552376  -0.2237669624
C   0.1272077148  -0.4370179383   0.8370544520
N   0.2611034406   1.9716242905   0.2653290971
H   0.3774604527   2.6701527890  -0.4812406899
H  -0.7136370395   2.0008911797   0.6020377400
H   1.6593033085   0.4899289459  -0.3573284705
C  -0.2098209242   0.3319038468  -1.5410051181
H   0.2544522166   0.9130033701  -2.3579409033
H  -1.2471043402   0.6823076785  -1.4040014066
O  -0.2921654042  -1.0464602197  -1.8182023905
O   0.7385298092  -1.4387384036   1.1187184882
H   0.5085713929  -1.3489093936  -2.2726524314
O  -1.0632733959  -0.0274293494   1.3667526911
H  -1.3715140745  -0.7071085383   1.9974973535
H   0.8666100060   2.2471555725   1.0497574586
