%chk=000297623.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297623

0 1
O -1.160102 -1.318630 -1.992620
O 0.831402 2.246909 0.267161
O 4.329207 -1.305218 0.694854
O -1.097696 3.401497 -0.002571
O 4.009035 0.080128 -1.064132
N -1.528995 0.277763 -0.436445
C 0.723243 -0.798008 -0.569346
C 1.572261 -1.592577 -1.569074
C -2.918571 0.484189 -0.931797
C -0.696541 -0.664655 -1.070922
C -1.138537 1.054123 0.747444
C 2.874863 -2.100348 -0.947912
C -3.911846 -0.272317 -0.083330
C -0.529155 2.379894 0.292898
C -3.977645 -1.670932 -0.177143
C -4.766243 0.411246 0.791647
C 3.766188 -0.969834 -0.516253
C -4.895030 -2.379128 0.601475
C -5.684713 -0.303243 1.567631
C -5.749700 -1.696595 1.474886
C 1.620146 3.399509 -0.211001
C 5.287925 -0.381001 1.298638
C 3.053278 2.977691 0.009442
C 6.623080 -0.485492 0.592038
H 0.720107 -1.295495 0.422356
H 1.185795 0.207625 -0.406543
H 1.792891 -0.958568 -2.454603
H 0.986786 -2.454797 -1.960032
H -2.971795 0.126954 -1.993625
H -3.137021 1.576760 -0.956529
H -2.031306 1.270574 1.386801
H -0.422355 0.495248 1.393215
H 2.669163 -2.779705 -0.090952
H 3.429641 -2.722329 -1.686118
H -3.307799 -2.196454 -0.862857
H -4.725479 1.496521 0.864649
H -4.947013 -3.464139 0.526455
H -6.351469 0.228834 2.243974
H -6.465659 -2.250288 2.078914
H 1.360839 3.546500 -1.273619
H 1.316699 4.280684 0.379402
H 5.313393 -0.757575 2.337707
H 4.863694 0.637741 1.258564
H 3.266624 2.791700 1.068583
H 3.290767 2.042969 -0.533598
H 3.751759 3.743154 -0.350140
H 6.963377 -1.526867 0.523823
H 6.561456 -0.096327 -0.435611
H 7.400047 0.085506 1.113815


%chk=000297623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297623

0 1
O -0.990072 -1.595763 -2.117821
O 0.684979 2.197707 0.673074
O 4.970916 -1.502035 0.491616
O -1.339881 3.045861 -0.123141
O 3.725314 0.130002 -0.614788
N -1.529675 -0.041687 -0.478229
C 0.734844 -1.122455 -0.432866
C 1.705340 -1.862602 -1.376468
C -2.849855 0.226052 -1.116249
C -0.646870 -0.943671 -1.080923
C -1.219063 0.726087 0.742577
C 3.029106 -2.254126 -0.693087
C -4.017424 -0.241100 -0.256352
C -0.672996 2.116627 0.390239
C -4.220531 -1.626429 -0.021241
C -4.913521 0.692391 0.321293
C 3.900258 -1.070555 -0.296925
C -5.299475 -2.067163 0.774629
C -5.996498 0.252906 1.118945
C -6.191106 -1.127878 1.348176
C 1.385156 3.465322 0.273404
C 5.957961 -0.462836 0.922077
C 2.859568 3.275963 0.611720
C 7.032274 -0.258784 -0.149858
H 0.607191 -1.706852 0.504181
H 1.162661 -0.145323 -0.146169
H 1.913065 -1.221472 -2.252096
H 1.210734 -2.770052 -1.764306
H -2.827904 -0.315448 -2.077493
H -2.926533 1.310432 -1.316597
H -2.155606 0.855835 1.314304
H -0.497084 0.190360 1.374109
H 2.855137 -2.869911 0.210188
H 3.635323 -2.887298 -1.371177
H -3.533465 -2.351405 -0.474304
H -4.764754 1.764469 0.140214
H -5.451970 -3.139248 0.943836
H -6.684299 0.984446 1.558082
H -7.030322 -1.470723 1.963990
H 1.212814 3.618573 -0.807001
H 0.915417 4.301010 0.823044
H 6.376309 -0.874470 1.854430
H 5.413330 0.475252 1.130172
H 2.999980 3.140380 1.698445
H 3.269525 2.395412 0.088967
H 3.427217 4.171917 0.299321
H 7.531748 -1.212521 -0.392388
H 6.593278 0.159772 -1.071040
H 7.798459 0.448229 0.219084


