%chk=000200297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200297

0 1
O 3.378397 -2.515051 -0.870292
N -2.047785 2.153606 1.011743
C -0.334371 0.653434 0.032152
C -1.420128 -0.237139 0.736080
C -0.588721 2.044701 0.694873
C -2.545140 0.743210 1.160137
C -0.560983 0.781454 -1.492220
C -1.938004 -1.413838 -0.096913
C 1.037724 0.070337 0.343955
C 0.457829 1.702598 -2.178199
C -2.767123 -2.391353 0.750342
C -2.793096 2.896002 -0.047291
C 1.557953 -0.961155 -0.455578
C 1.781583 0.510104 1.450198
C 0.166436 1.853684 -3.668885
C -3.281098 -3.562726 -0.083478
C 2.805704 -1.506023 -0.130230
C 3.027574 -0.050926 1.753317
C 3.563298 -1.068594 0.967948
H -0.953397 -0.650630 1.665640
H -0.053096 2.131579 1.668763
H -0.228192 2.877600 0.063101
H -3.479425 0.562288 0.597440
H -2.792020 0.610009 2.234590
H -1.588485 1.166332 -1.668475
H -0.529040 -0.216069 -1.970231
H -1.079318 -1.955633 -0.541543
H -2.545337 -1.052842 -0.948424
H 1.483183 1.306498 -2.032946
H 0.451588 2.699891 -1.691268
H -3.620997 -1.861209 1.215364
H -2.154960 -2.772570 1.591737
H -2.425230 3.933919 -0.077691
H -3.858424 2.939481 0.227502
H -2.705194 2.465462 -1.059189
H 1.003650 -1.326042 -1.314787
H 1.384497 1.299854 2.091211
H 0.200353 0.889659 -4.188486
H -0.823500 2.288151 -3.847252
H 0.902328 2.508921 -4.149450
H -3.921127 -3.224790 -0.906158
H -2.458441 -4.138616 -0.522247
H -3.872509 -4.253439 0.528585
H 3.585453 0.312834 2.617064
H 4.527271 -1.521132 1.180318
H 2.811621 -2.786528 -1.631524


%chk=000200297-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200297

0 1
O 3.975358 -2.003341 -0.649913
N -1.656027 1.928120 1.291513
C -0.364180 0.586714 -0.284525
C -1.464568 -0.287854 0.496612
C -0.733406 2.055606 0.138699
C -2.502031 0.756860 0.968764
C -0.499547 0.468335 -1.831644
C -2.052330 -1.495229 -0.261155
C 1.026936 0.163964 0.235069
C 0.430572 1.400586 -2.645501
C -3.018064 -2.337543 0.606115
C -2.384107 3.159977 1.627008
C 1.871612 -0.713017 -0.491548
C 1.454002 0.589407 1.522942
C 0.248233 1.222339 -4.168313
C -3.529089 -3.597173 -0.125599
C 3.110403 -1.135220 0.048463
C 2.692597 0.164247 2.050184
C 3.536554 -0.699976 1.320465
H -0.967569 -0.672830 1.407491
H 0.148741 2.664370 0.404658
H -1.246397 2.563133 -0.718892
H -3.240386 0.977564 0.150491
H -3.068930 0.430676 1.859100
H -1.549338 0.701205 -2.104321
H -0.333151 -0.577015 -2.159323
H -1.223630 -2.150881 -0.601026
H -2.587024 -1.161073 -1.172726
H 1.485807 1.212312 -2.371636
H 0.227037 2.455794 -2.376091
H -3.882505 -1.714318 0.910677
H -2.501725 -2.634581 1.541719
H -1.667494 3.959856 1.886627
H -3.032641 2.986815 2.504351
H -3.025910 3.532601 0.787293
H 1.572919 -1.073977 -1.484173
H 0.794525 1.234670 2.114818
H 0.476561 0.184779 -4.479779
H -0.793089 1.439191 -4.474178
H 0.914077 1.897756 -4.736255
H -4.066297 -3.326564 -1.054442
H -2.689121 -4.260676 -0.405982
H -4.222544 -4.180436 0.507772
H 3.005101 0.504595 3.043976
H 4.499743 -1.040626 1.711119
H 3.591626 -2.243840 -1.529603


