%chk=000294240.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294240

0 1
O 2.906261 3.285611 -0.195385
N 1.244234 -2.054871 0.208884
N -1.526173 1.031308 0.126097
C 1.735092 -0.717014 0.026439
C 2.252792 -3.147211 0.019564
C 3.543230 -2.792788 0.766221
C 3.116341 -0.420199 0.073329
C 4.145927 -1.511646 0.184573
C -0.010281 -2.365599 -0.550417
C 0.797974 0.351778 -0.066165
C -1.063371 -1.323752 -0.301882
C -0.649696 0.047138 -0.076560
C 3.558738 0.908441 0.004055
C 1.239423 1.672180 -0.136736
C 2.620078 1.936209 -0.104991
C -2.401298 -1.625598 -0.306237
C -3.364413 -0.589345 -0.095195
C -2.884719 0.733419 0.118937
C -4.772340 -0.825423 -0.087769
C -3.815715 1.801600 0.336611
C -5.645668 0.213495 0.122639
C -5.161953 1.538366 0.336620
C 4.295170 3.682428 -0.132440
H 2.471240 -3.341222 -1.053309
H 1.812114 -4.077444 0.443016
H 4.262512 -3.629094 0.703266
H 3.323461 -2.648670 1.845107
H -0.364389 -3.364527 -0.202278
H 0.165251 -2.445561 -1.650552
H 4.575834 -1.707128 -0.820508
H 4.995022 -1.179169 0.816013
H 4.622244 1.122105 0.037328
H 0.529070 2.501023 -0.203600
H -2.754894 -2.643595 -0.465231
H -5.134749 -1.839091 -0.250332
H -3.420442 2.805520 0.499535
H -6.721345 0.044340 0.130581
H -5.884483 2.337262 0.500955
H 4.849507 3.266407 -0.978117
H 4.732395 3.391269 0.826772
H 4.218818 4.774847 -0.212541


%chk=000294240-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294240

0 1
O 2.926028 3.366852 -0.135006
N 1.292984 -2.063077 0.001023
N -1.542234 1.046083 0.021892
C 1.744368 -0.725456 -0.056757
C 2.266502 -3.169973 0.000950
C 3.538092 -2.787279 0.776901
C 3.132796 -0.406113 0.034495
C 4.165430 -1.520494 0.157313
C -0.008062 -2.383063 -0.611403
C 0.789520 0.345851 -0.150160
C -1.064716 -1.343286 -0.295209
C -0.653888 0.036466 -0.147893
C 3.544681 0.944550 0.018854
C 1.228613 1.687805 -0.173564
C 2.599479 1.994302 -0.098100
C -2.419100 -1.654725 -0.221606
C -3.389143 -0.615169 -0.039289
C -2.892151 0.743440 0.063830
C -4.797583 -0.854155 0.033482
C -3.828425 1.815256 0.228385
C -5.689100 0.210641 0.196950
C -5.199746 1.552952 0.293154
C 4.340461 3.719049 -0.042218
H 2.539842 -3.458665 -1.043231
H 1.782368 -4.051198 0.465607
H 4.250616 -3.632115 0.749955
H 3.274198 -2.599584 1.834466
H -0.330857 -3.377233 -0.247728
H 0.095722 -2.467844 -1.724126
H 4.576840 -1.771789 -0.842730
H 5.020688 -1.176509 0.768550
H 4.616620 1.158609 0.094717
H 0.483573 2.485322 -0.230861
H -2.757481 -2.694488 -0.317594
H -5.169572 -1.883461 -0.042946
H -3.428168 2.831018 0.303911
H -6.767077 0.023113 0.252260
H -5.910074 2.377486 0.420569
H 4.922375 3.296555 -0.886163
H 4.783580 3.378165 0.915299
H 4.368799 4.817959 -0.089683


