%chk=000240870.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240870

0 1
O -1.630755 1.726896 -1.121387
N 0.317031 0.025521 -0.110796
N -1.030897 -0.214532 0.026538
N 6.670295 0.671727 -0.323368
N -6.031955 -0.529003 -0.016068
C 2.622557 -0.366610 0.236648
C 1.205859 -0.738596 0.466747
C 3.563287 -1.349743 -0.112703
C 3.031871 0.974196 0.351409
C 5.304433 0.334569 -0.196792
C 4.895225 -1.011497 -0.330784
C 4.360584 1.329405 0.141432
C 0.939156 -1.939484 1.327103
C -3.363681 0.252504 -0.349678
C -1.937795 0.709848 -0.552690
C -4.097188 0.723064 0.742900
C -3.960973 -0.604954 -1.277775
C -5.433938 0.306863 0.871389
C -5.303091 -0.970228 -1.073431
H 3.249209 -2.387704 -0.224585
H 2.295592 1.743471 0.598692
H 5.615459 -1.780339 -0.594489
H 4.666830 2.367065 0.242663
H 0.182424 -1.735859 2.096603
H 0.602514 -2.797288 0.729402
H 1.841209 -2.260859 1.870127
H -1.381431 -1.047811 0.509831
H -3.653880 1.404202 1.467630
H -3.410104 -0.969809 -2.143328
H 6.883283 1.639003 -0.517982
H 7.249197 0.035675 -0.850998
H -6.057224 0.648272 1.707237
H -5.823204 -1.636566 -1.772794


%chk=000240870-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240870

0 1
O -1.701627 2.074212 0.024952
N 0.353909 0.154906 0.024739
N -0.993421 -0.170066 0.085379
N 6.735682 0.824686 -0.171429
N -6.133200 -0.476771 0.054054
C 2.663218 -0.436471 0.074230
C 1.239316 -0.830195 0.156510
C 3.729929 -1.379048 0.057900
C 3.012970 0.948536 -0.002052
C 5.409201 0.409568 -0.094118
C 5.073770 -0.972958 -0.025358
C 4.345712 1.365085 -0.081711
C 0.825077 -2.279419 0.380371
C -3.386848 0.327355 0.035916
C -1.964291 0.840279 0.038625
C -4.402803 1.198878 0.501867
C -3.780919 -0.949225 -0.444032
C -5.742917 0.758037 0.498442
C -5.149763 -1.300858 -0.414242
H 3.526175 -2.454352 0.098049
H 2.201798 1.682696 0.004529
H 5.870614 -1.726522 -0.039326
H 4.580073 2.435524 -0.133764
H 0.137808 -2.367776 1.245770
H 0.308633 -2.694940 -0.508469
H 1.684524 -2.928434 0.593688
H -1.304649 -1.141431 0.214892
H -4.130026 2.200598 0.846611
H -3.062000 -1.654111 -0.877433
H 6.969063 1.812148 -0.223235
H 7.495508 0.150341 -0.179488
H -6.547237 1.407517 0.860865
H -5.483381 -2.276389 -0.786030


