%chk=000207938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207938

0 1
O -0.118113 0.752749 0.237111
O -2.404432 1.831917 0.571903
O 7.488724 -0.507886 0.228795
N -3.642650 0.318662 -0.615397
N 6.208043 -0.009437 0.458753
C -5.667564 -1.356347 0.695506
C -5.485097 0.119370 1.073942
C -4.366035 -1.954352 0.142296
C -4.902235 0.932439 -0.093263
C -3.828186 -1.101076 -1.019978
C -2.432765 0.795978 -0.058736
C -1.172712 0.011129 -0.430031
C 1.173558 0.313862 0.058722
C 1.570800 -0.791121 -0.703835
C 2.108199 1.115965 0.750650
C 3.882990 -0.316860 -0.093648
C 2.933685 -1.095863 -0.772170
C 3.453812 0.793871 0.668711
C 5.304498 -0.682034 -0.198543
H -6.000171 -1.932774 1.579703
H -6.475816 -1.455244 -0.054796
H -6.451800 0.557337 1.385495
H -4.817487 0.204820 1.954966
H -3.611189 -2.019109 0.949506
H -4.538002 -2.991369 -0.200890
H -5.622438 0.989563 -0.937519
H -4.688111 1.979117 0.229871
H -2.888149 -1.525761 -1.422740
H -4.555539 -1.109367 -1.866380
H -0.995763 0.021597 -1.521374
H -1.189193 -1.019965 -0.035065
H 0.856120 -1.406380 -1.236987
H 1.752704 1.967929 1.329919
H 3.253407 -1.954529 -1.364208
H 4.192886 1.402855 1.197354
H 5.538378 -1.539121 -0.852604
H 8.071144 0.101135 0.791859


%chk=000207938-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207938

0 1
O -0.016774 0.981205 0.318145
O -2.440624 2.036404 0.718653
O 7.666523 -0.661958 -0.137477
N -3.600906 0.215914 -0.162097
N 6.400680 0.031966 0.127339
C -5.986768 -1.420236 0.275770
C -5.839100 -0.017491 0.911402
C -4.597416 -2.062587 0.052143
C -4.909070 0.876920 0.062837
C -3.683782 -1.126456 -0.777746
C -2.432670 0.887575 0.192495
C -1.117961 0.128037 -0.103140
C 1.281722 0.483868 0.143252
C 1.604745 -0.779268 -0.412908
C 2.315581 1.358857 0.574511
C 4.005281 -0.292237 -0.105823
C 2.960725 -1.153252 -0.530907
C 3.656255 0.976076 0.451508
C 5.396083 -0.732118 -0.252934
H -6.611730 -2.072384 0.913745
H -6.508893 -1.328275 -0.699557
H -6.826571 0.472872 1.004606
H -5.418451 -0.109808 1.931562
H -4.118336 -2.260248 1.031307
H -4.693989 -3.032251 -0.473049
H -5.380086 1.078942 -0.922821
H -4.706274 1.841942 0.554000
H -2.679352 -1.567394 -0.876544
H -4.101868 -1.025272 -1.802785
H -1.037435 -0.093404 -1.188625
H -1.092978 -0.831937 0.455217
H 0.827413 -1.469820 -0.752885
H 2.030190 2.326054 0.998705
H 3.209855 -2.131119 -0.961134
H 4.455677 1.646479 0.782031
H 5.585349 -1.725937 -0.692330
H 8.340455 -0.007958 0.180431


