%chk=000188382.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188382

0 1
O 7.277335 1.227282 0.147494
O 8.302267 -1.090018 -0.583689
N 6.922017 -0.983832 -0.313202
C 0.185352 0.109619 0.241541
C 1.564870 0.037841 -0.426777
C -0.943226 -0.047892 -0.786498
C 2.692871 0.197732 0.601501
C -2.321063 0.022284 -0.116429
C 4.069706 0.123133 -0.070564
C -3.454362 -0.132990 -1.143054
C 5.196897 0.283880 0.958119
C -4.797081 -0.063244 -0.467267
C 6.556881 0.262701 0.301198
C -5.410178 -1.232090 0.010169
C -5.442086 1.172361 -0.301807
C -6.655087 -1.163879 0.641007
C -6.686867 1.234946 0.329778
C -7.296692 0.068289 0.801916
H 0.074806 1.073213 0.775983
H 0.099907 -0.676123 1.016952
H 1.674061 -0.925589 -0.961601
H 1.647797 0.823790 -1.202811
H -0.859715 0.739288 -1.560752
H -0.832955 -1.010259 -1.322733
H 2.582269 1.163971 1.131998
H 2.605908 -0.585120 1.379546
H -2.410057 -0.765287 0.657333
H -2.435741 0.984119 0.420943
H 4.177674 -0.838616 -0.610482
H 4.157055 0.913565 -0.844328
H -3.343960 -1.092581 -1.687556
H -3.371263 0.652641 -1.921206
H 5.086066 1.256570 1.490085
H 5.123400 -0.492414 1.744561
H -4.915583 -2.193452 -0.109776
H -4.972231 2.083870 -0.664764
H -7.126729 -2.073798 1.008133
H -7.183285 2.195839 0.454232
H -8.265969 0.119070 1.292115
H 6.690530 -1.865884 0.145169
H 8.524663 -0.273136 -1.152977


%chk=000188382-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188382

0 1
O 6.913030 0.952528 -0.848042
O 8.882392 -0.677761 -0.163546
N 7.600190 -0.757446 0.486099
C 0.164778 0.070257 0.170799
C 1.546546 -0.004572 -0.517006
C -1.014708 0.011317 -0.825812
C 2.727487 0.048510 0.478155
C -2.396164 0.065863 -0.137523
C 4.102436 -0.024304 -0.220452
C -3.576113 -0.005489 -1.147082
C 5.279738 0.024406 0.784829
C -4.934955 0.018846 -0.462917
C 6.623533 0.118208 0.082422
C -5.526369 -1.179800 0.015189
C -5.624090 1.240532 -0.247634
C -6.767672 -1.160736 0.690028
C -6.866056 1.266309 0.427083
C -7.442651 0.064595 0.899605
H 0.098619 1.007193 0.762333
H 0.071232 -0.763361 0.898094
H 1.609437 -0.940277 -1.110998
H 1.641870 0.830181 -1.242043
H -0.929042 0.851193 -1.546934
H -0.941190 -0.920470 -1.425513
H 2.665448 0.985880 1.069978
H 2.631293 -0.786149 1.204397
H -2.486925 -0.771535 0.583792
H -2.484017 0.998103 0.456330
H 4.168214 -0.954345 -0.819856
H 4.215911 0.817109 -0.929524
H -3.469380 -0.931999 -1.745872
H -3.489694 0.843793 -1.853314
H 5.171798 0.924483 1.422357
H 5.250659 -0.855113 1.458670
H -5.011333 -2.134939 -0.149904
H -5.185679 2.176583 -0.616607
H -7.210420 -2.097829 1.047109
H -7.385135 2.219673 0.579849
H -8.407102 0.082038 1.419689
H 7.566311 -1.494389 1.187152
H 8.705978 0.082714 -0.811881


