%chk=000186124.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186124

0 1
O 4.305147 -2.056306 1.147336
O 5.112720 -0.887018 -0.576679
N 1.912374 1.980158 0.004257
N -3.927520 0.516776 0.145797
C 0.619462 1.281733 -0.334344
C -0.503187 2.018992 0.465828
C 0.665816 -0.217646 -0.021919
C -1.794850 1.308323 0.304538
C -1.759778 -0.094898 0.004158
C -0.627991 -0.914455 -0.179886
C 3.114342 1.146243 -0.311186
C 3.066410 -0.115512 0.576932
C 1.775646 -0.854229 0.377242
C -3.093474 -0.584248 -0.094848
C -3.129625 1.667364 0.388717
C 2.013164 3.285411 -0.718014
C -0.857613 -2.248424 -0.474759
C -3.310879 -1.949626 -0.392667
C 4.255871 -0.997083 0.267636
C -2.190790 -2.743106 -0.575362
C -5.391982 0.488530 0.155978
H 0.379437 1.364744 -1.430640
H -0.569489 3.073058 0.135511
H -0.219267 2.052520 1.541495
H 4.026130 1.738814 -0.077211
H 3.188266 0.853333 -1.382064
H 3.121561 0.192147 1.661865
H 1.793914 -1.918944 0.609915
H -3.572982 2.621639 0.597575
H 2.911378 3.819199 -0.366433
H 1.145816 3.914065 -0.455880
H 2.062743 3.205277 -1.814245
H -0.032565 -2.935776 -0.638549
H -4.314258 -2.350306 -0.473306
H -2.319801 -3.800681 -0.808206
H -5.808177 1.488970 0.362437
H -5.784125 0.151232 -0.821485
H -5.765524 -0.202934 0.934224
H 5.076581 -2.659836 0.976740


%chk=000186124-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186124

0 1
O 4.283087 -2.254710 0.775824
O 5.194743 -0.767542 -0.751433
N 1.940199 1.965759 0.062713
N -3.972375 0.517751 0.019128
C 0.642678 1.309729 -0.265853
C -0.538218 2.078650 0.429759
C 0.665241 -0.196612 0.090094
C -1.835110 1.336358 0.226726
C -1.787459 -0.081968 0.025744
C -0.636908 -0.901420 -0.024666
C 3.108072 1.149932 -0.344405
C 3.153381 -0.128425 0.511040
C 1.809424 -0.833681 0.467637
C -3.115450 -0.587349 -0.093199
C -3.185352 1.682409 0.212178
C 2.041670 3.344251 -0.463028
C -0.860128 -2.287420 -0.205627
C -3.336831 -1.973218 -0.268224
C 4.300551 -1.034333 0.081296
C -2.187003 -2.799895 -0.318273
C -5.432582 0.466911 -0.049197
H 0.448881 1.366032 -1.372945
H -0.600338 3.104971 0.027160
H -0.287064 2.162465 1.506093
H 4.025481 1.742409 -0.186180
H 3.080851 0.867747 -1.425463
H 3.369087 0.158004 1.564402
H 1.789580 -1.888905 0.761852
H -3.668588 2.651869 0.326683
H 3.041206 3.747113 -0.224376
H 1.298120 4.002667 0.014791
H 1.899451 3.403862 -1.571807
H -0.015341 -2.980358 -0.287710
H -4.338866 -2.404535 -0.365177
H -2.321881 -3.878272 -0.461804
H -5.841211 1.483000 0.070973
H -5.772487 0.068880 -1.023702
H -5.846738 -0.170637 0.754406
H 5.061126 -2.803990 0.485067


