%chk=000207036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207036

0 1
O 1.750207 -1.508590 -1.820585
O -4.669469 2.433344 -1.286696
N 2.808281 1.429649 -0.080163
N 0.774411 -0.534383 -0.003079
C 4.019957 2.002350 0.597066
C 2.321386 2.331742 -1.178423
C 3.673856 3.372717 1.203117
C 1.953517 3.705804 -0.596497
C 3.147463 4.335152 0.131490
C 3.110440 0.068705 -0.621023
C -0.510822 -1.260402 -0.176550
C 1.824497 -0.714622 -0.889414
C -0.806164 -2.144721 1.054116
C -1.624170 -0.255889 -0.408301
C 0.113466 -3.321697 1.242688
C -2.063237 0.599412 0.607402
C -2.212081 -0.173182 -1.686044
C 0.895524 -3.847123 0.205148
C 0.155815 -3.931150 2.510147
C -3.085334 1.527109 0.377935
C -3.228862 0.736823 -1.942118
C -3.658512 1.583351 -0.897332
C 1.706880 -4.962774 0.430744
C 0.966820 -5.046102 2.729654
C 1.745167 -5.566741 1.690427
C -5.203370 3.348541 -0.300097
H 4.319994 1.303493 1.407953
H 4.888300 2.100557 -0.089306
H 1.418056 1.863133 -1.628789
H 3.064520 2.451413 -1.995807
H 4.567288 3.794658 1.698208
H 2.908753 3.242605 1.994489
H 1.103896 3.593031 0.106260
H 1.600156 4.368224 -1.407796
H 3.949686 4.577807 -0.590902
H 2.850144 5.294545 0.593550
H 3.704519 -0.510334 0.124036
H 3.711850 0.072226 -1.559086
H -0.408011 -1.928952 -1.084514
H 0.828360 0.173812 0.728000
H -1.848336 -2.527371 0.963098
H -0.802598 -1.521694 1.972667
H -1.608920 0.550700 1.597374
H -1.863301 -0.829599 -2.486435
H 0.891519 -3.381325 -0.786555
H -0.445250 -3.536332 3.325631
H -3.413150 2.179797 1.178795
H -3.696942 0.813581 -2.920971
H 2.312027 -5.359666 -0.383442
H 0.992831 -5.511516 3.713134
H 2.375798 -6.435209 1.862175
H -5.971686 3.878038 -0.879035
H -5.651306 2.794525 0.529648
H -4.425262 4.037530 0.040011


%chk=000207036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207036

0 1
O 1.329768 -1.604655 -2.318511
O -4.635273 2.772870 -1.481760
N 2.806664 1.164249 -0.382055
N 0.714842 -0.548951 -0.320066
C 4.092551 1.511341 0.283105
C 2.210715 2.336716 -1.083972
C 3.893733 2.651657 1.302098
C 1.962269 3.500939 -0.104722
C 3.267660 3.892588 0.625051
C 2.899323 -0.020435 -1.267130
C -0.613680 -1.180629 -0.188273
C 1.568133 -0.792527 -1.367021
C -0.745493 -1.919284 1.164200
C -1.723298 -0.148108 -0.448495
C 0.284709 -3.016026 1.429945
C -2.650608 0.280790 0.526836
C -1.812369 0.422216 -1.750222
C 0.930064 -3.737296 0.391914
C 0.572745 -3.370132 2.774239
C -3.639327 1.251694 0.232809
C -2.784969 1.384532 -2.062068
C -3.704387 1.806694 -1.066603
C 1.827225 -4.787081 0.695184
C 1.467424 -4.419095 3.080351
C 2.099057 -5.135860 2.037685
C -5.617098 3.231448 -0.497317
H 4.473337 0.606225 0.791864
H 4.861624 1.822874 -0.469371
H 1.259153 2.017066 -1.547854
H 2.884736 2.681768 -1.909388
H 4.868641 2.905939 1.760414
H 3.226990 2.294696 2.111256
H 1.199405 3.190151 0.635745
H 1.550167 4.363879 -0.661552
H 3.986645 4.312250 -0.108813
H 3.071831 4.683755 1.373078
H 3.647234 -0.724724 -0.854884
H 3.220301 0.223291 -2.304697
H -0.651649 -1.920647 -1.011291
H 1.047233 0.164025 0.347344
H -1.761423 -2.364670 1.200985
H -0.702072 -1.185179 1.994064
H -2.623371 -0.138957 1.537709
H -1.109542 0.092575 -2.525144
H 0.754250 -3.479592 -0.658512
H 0.088710 -2.817436 3.590311
H -4.342435 1.556364 1.013959
H -2.860768 1.818469 -3.063783
H 2.316354 -5.329458 -0.122034
H 1.672227 -4.674742 4.126479
H 2.794613 -5.950678 2.268522
H -6.234681 3.969931 -1.029287
H -6.254682 2.397133 -0.144611
H -5.124606 3.713039 0.370292


