%chk=000182374.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182374

0 1
O -0.302639 -0.818774 -1.174454
O 1.948172 -0.107741 -2.339039
N 2.879371 -0.842859 1.159080
C 2.113854 -0.912534 -1.169658
C 2.530341 0.017439 -0.006522
C 2.644192 -0.186591 2.482815
C 0.818360 -1.693042 -0.880903
C -1.212049 1.284925 -0.636127
C -1.059821 1.662158 -2.080593
C -0.758119 0.027094 -0.172811
C 3.541808 1.037700 2.727804
C 2.865921 -1.245281 3.572135
C -2.158058 1.018745 -2.943260
C -1.794837 2.148116 0.296152
C -0.838600 -0.344503 1.172523
C -2.017319 1.401256 -4.413036
C -1.897027 1.784702 1.645079
C -1.416533 0.547312 2.080505
H 2.940833 -1.605843 -1.446079
H 3.362752 0.668239 -0.349417
H 1.692486 0.703437 0.244373
H 1.569498 0.140879 2.505294
H 3.853400 -1.152416 1.081408
H 0.781407 -2.084506 0.149732
H 0.651939 -2.506433 -1.611242
H -1.069217 2.762268 -2.206112
H -0.056842 1.324880 -2.447558
H 3.351663 1.474096 3.714368
H 4.605510 0.782587 2.689517
H 3.364222 1.824504 1.987552
H 2.275701 -2.147724 3.367456
H 2.566631 -0.866031 4.554345
H 3.914136 -1.553792 3.643483
H -3.154364 1.318483 -2.564616
H -2.108539 -0.084990 -2.830333
H -2.169509 3.118246 -0.029824
H -0.459842 -1.310278 1.501537
H 1.021826 0.285482 -2.360223
H -2.089605 2.484369 -4.561283
H -1.054606 1.076171 -4.825355
H -2.803289 0.934501 -5.018117
H -2.352513 2.471723 2.354741
H -1.494893 0.270225 3.130861


%chk=000182374-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182374

0 1
O 0.227856 0.007576 -1.391451
O 2.902619 -0.101960 -2.281526
N 2.721470 -0.907398 1.402792
C 2.517521 -0.858745 -1.079987
C 2.927426 -0.080460 0.191465
C 2.872494 -0.208446 2.712544
C 1.023624 -1.219319 -1.148796
C -1.537228 1.516242 -0.795253
C -1.696277 1.859209 -2.266762
C -0.573346 0.559630 -0.360265
C 4.297097 0.353036 2.969037
C 2.443555 -1.170910 3.838612
C -2.493377 0.781999 -3.055866
C -2.358720 2.110053 0.191738
C -0.433583 0.216521 1.004822
C -2.632144 1.137814 -4.551117
C -2.248032 1.769299 1.560325
C -1.281574 0.821811 1.961104
H 3.102628 -1.797934 -1.140991
H 3.976143 0.259460 0.038608
H 2.301776 0.828879 0.283401
H 2.162898 0.644003 2.688476
H 3.304504 -1.759021 1.379583
H 0.695034 -1.745166 -0.237015
H 0.840349 -1.847923 -2.037555
H -2.216691 2.832264 -2.363567
H -0.703274 1.969106 -2.742973
H 4.335539 0.904160 3.927050
H 5.036776 -0.469769 3.020104
H 4.608741 1.047701 2.168338
H 1.415121 -1.535334 3.668637
H 2.484228 -0.670115 4.822470
H 3.116281 -2.050255 3.881909
H -3.496023 0.667040 -2.599156
H -1.977379 -0.190145 -2.945808
H -3.102693 2.850975 -0.126472
H 0.344103 -0.487537 1.327435
H 2.193876 0.580037 -2.426150
H -3.155744 2.103668 -4.685338
H -1.638807 1.224925 -5.030675
H -3.204188 0.365146 -5.096946
H -2.901942 2.242298 2.300752
H -1.174835 0.553785 3.018665


