%chk=000187700.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187700

0 1
O -6.380573 -0.397816 -0.884949
O -4.953331 1.172306 -1.677182
N -2.325389 0.377982 1.499793
N -5.157167 -1.910100 1.912725
C 3.937148 0.614194 0.520816
C 5.028236 -0.254292 -0.119949
C 2.557502 -0.048157 0.407169
C 6.408747 0.406497 -0.006821
C 1.466489 0.820615 1.048021
C 7.499433 -0.461920 -0.647808
C 0.089817 0.155193 0.932526
C 8.881375 0.197393 -0.535623
C -0.996258 1.032282 1.575161
C 9.970661 -0.662960 -1.172042
C -3.174089 0.596371 0.458872
C -4.378873 -0.065456 0.297028
C -5.211306 0.325516 -0.842391
C -4.822413 -1.080690 1.176107
C -7.283575 -0.088549 -1.981468
H 3.919348 1.610446 0.037853
H 4.181704 0.798997 1.584763
H 5.048663 -1.251208 0.361411
H 4.786784 -0.439251 -1.184641
H 2.317006 -0.233523 -0.658035
H 2.579266 -1.045458 0.888330
H 6.652390 0.590947 1.057278
H 6.390318 1.402974 -0.488958
H 1.713221 1.004710 2.112173
H 1.450413 1.816628 0.563118
H 7.520369 -1.458996 -0.167400
H 7.258604 -0.647342 -1.712265
H 0.110983 -0.844119 1.411626
H -0.152522 -0.033565 -0.132822
H 9.125486 0.381502 0.528956
H 8.863338 1.194127 -1.018376
H -0.763778 1.220027 2.649795
H -1.031171 2.031821 1.084452
H 9.779950 -0.833278 -2.237762
H 10.952962 -0.184755 -1.087427
H 10.042032 -1.645351 -0.691504
H -2.515235 -0.354550 2.182821
H -2.893423 1.369206 -0.287001
H -8.114242 -0.778915 -1.798571
H -6.785505 -0.286762 -2.935437
H -7.595998 0.958178 -1.916361


%chk=000187700-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187700

0 1
O -6.799803 -0.315045 -0.620285
O -5.487259 1.463026 -1.389389
N -2.342468 0.217873 1.131233
N -4.943908 -2.216672 1.770031
C 4.030284 0.594016 0.369621
C 5.210946 -0.278574 -0.112734
C 2.663063 -0.118208 0.264328
C 6.579262 0.431907 -0.007259
C 1.485219 0.751351 0.759133
C 7.761894 -0.444081 -0.478704
C 0.121821 0.031529 0.654454
C 9.130505 0.267008 -0.374360
C -1.039932 0.909365 1.172625
C 10.307040 -0.618630 -0.838753
C -3.383894 0.572697 0.337044
C -4.611419 -0.092611 0.262603
C -5.628483 0.446840 -0.655515
C -4.838068 -1.251988 1.064016
C -7.887424 0.148909 -1.510033
H 4.002637 1.532429 -0.222898
H 4.206395 0.896628 1.423208
H 5.239253 -1.216696 0.480281
H 5.036248 -0.582561 -1.166060
H 2.483517 -0.414427 -0.789950
H 2.694777 -1.059873 0.851068
H 6.751114 0.742069 1.044941
H 6.554531 1.366559 -0.606088
H 1.668293 1.046687 1.813557
H 1.453854 1.692648 0.171719
H 7.789318 -1.377968 0.121233
H 7.592032 -0.756371 -1.530555
H 0.158628 -0.911045 1.238450
H -0.078675 -0.253523 -0.396686
H 9.296979 0.583960 0.675608
H 9.104949 1.196838 -0.978740
H -0.829582 1.222876 2.214834
H -1.123095 1.829251 0.565777
H 10.178277 -0.927304 -1.893494
H 11.272634 -0.086199 -0.758140
H 10.375868 -1.538181 -0.227228
H -2.449903 -0.616088 1.720164
H -3.253342 1.458081 -0.296329
H -8.711097 -0.556485 -1.332313
H -7.560575 0.121147 -2.563429
H -8.183016 1.179734 -1.250986


