%chk=000212113.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212113

0 1
N -0.179887 -3.831142 -0.317402
C -0.749806 -0.083198 -0.317143
C 0.022205 0.975009 0.049510
C -0.834192 2.140888 0.525898
C -2.171665 0.271224 -0.124219
C -2.235572 1.604392 0.383126
C -0.308140 -1.410934 -0.821694
C -0.415612 -2.478065 0.286803
C 1.480701 1.092956 0.021803
C -3.335034 -0.451313 -0.353138
C -3.453264 2.203672 0.660115
C -4.567900 0.160409 -0.070831
C -4.626249 1.463921 0.427327
C 2.173607 1.022942 -1.198366
C 2.200461 1.284439 1.212344
C 3.563417 1.141110 -1.226530
C 3.590862 1.400185 1.183562
C -0.736094 -4.899759 0.566692
C 1.275587 -4.068705 -0.554172
C 4.283565 1.328977 -0.035636
C 5.771013 1.469188 -0.068369
H -0.667035 3.041647 -0.094024
H -0.597636 2.423198 1.567759
H 0.733858 -1.362702 -1.200605
H -0.925065 -1.719654 -1.693953
H 0.283979 -2.235187 1.113989
H -1.439579 -2.451304 0.720474
H -3.295927 -1.465806 -0.744295
H -3.508796 3.217424 1.045723
H -5.489205 -0.392202 -0.245357
H 1.619744 0.881888 -2.125980
H 1.670978 1.335613 2.162376
H -5.592594 1.918246 0.638787
H 4.089759 1.089191 -2.177423
H 4.138697 1.546853 2.112052
H -1.824507 -4.756395 0.659899
H -0.302149 -4.940606 1.576011
H -0.582009 -5.878684 0.085113
H 1.399937 -5.032538 -1.072494
H 1.897041 -4.079305 0.352960
H 1.663869 -3.286790 -1.226751
H 6.243940 1.122789 0.859982
H 6.225114 0.900142 -0.890403
H 6.058084 2.522487 -0.205519


%chk=000212113-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212113

0 1
N -0.379521 -3.909089 -0.347429
C -0.694590 -0.080175 -0.338355
C 0.085522 0.977396 0.107525
C -0.810063 2.078637 0.685899
C -2.120491 0.253998 -0.125676
C -2.213218 1.540924 0.484324
C -0.259535 -1.433654 -0.854572
C -0.484348 -2.541521 0.214441
C 1.555651 1.130954 0.069775
C -3.292748 -0.473795 -0.439304
C -3.461822 2.106991 0.787386
C -4.550323 0.099622 -0.135190
C -4.637888 1.376187 0.474476
C 2.327726 0.741384 -1.062951
C 2.254343 1.724423 1.160232
C 3.726691 0.912211 -1.088438
C 3.653885 1.891420 1.131021
C -0.894146 -4.927679 0.591345
C 0.978867 -4.244922 -0.821081
C 4.420630 1.487386 0.007693
C 5.924060 1.697417 -0.036343
H -0.648044 3.043535 0.165621
H -0.591995 2.265067 1.757298
H 0.802604 -1.417258 -1.145489
H -0.847777 -1.714952 -1.750374
H 0.236973 -2.375776 1.056621
H -1.500140 -2.432257 0.636298
H -3.234476 -1.458122 -0.918061
H -3.535168 3.096090 1.254847
H -5.469341 -0.447402 -0.375277
H 1.818756 0.341418 -1.946611
H 1.696998 2.037278 2.050995
H -5.621713 1.802148 0.701759
H 4.289385 0.606671 -1.979493
H 4.161262 2.339736 1.994405
H -1.936842 -4.687421 0.866350
H -0.297389 -5.006372 1.536324
H -0.889003 -5.919322 0.103505
H 0.976153 -5.262478 -1.251456
H 1.748172 -4.214334 -0.006678
H 1.294024 -3.546764 -1.614705
H 6.365844 1.677707 0.975640
H 6.424022 0.921374 -0.642692
H 6.177515 2.677816 -0.485606


