%chk=000207626.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207626

0 1
N -3.989774 -0.247393 -0.269055
N -0.239244 -0.627689 -0.030873
C -5.064696 -0.085934 0.767619
C -4.530312 -1.267313 -1.229896
C -5.890659 -1.390722 0.817891
C -5.553416 -2.149252 -0.478651
C -2.685769 -0.668150 0.337343
C -1.564711 -0.374375 -0.683275
C 0.123010 0.400969 0.990232
C 0.834653 -0.796852 -1.065123
C 0.394703 1.800163 0.481890
C 2.019062 -1.506665 -0.449847
C 1.705040 2.292914 0.323533
C 3.241146 -0.848132 -0.214305
C 2.916242 1.474837 0.685576
C 3.415026 0.620296 -0.497083
C -0.692250 2.634066 0.174550
C 1.890800 -2.865567 -0.121575
C 1.899686 3.593238 -0.171895
C 4.319813 -1.569803 0.322542
C -0.490027 3.926190 -0.312954
C 2.967206 -3.573127 0.415773
C 0.811104 4.405332 -0.492426
C 4.186969 -2.924289 0.632430
H -5.696446 0.765141 0.433796
H -4.654558 0.186669 1.755657
H -3.727610 -1.867435 -1.693751
H -5.025876 -0.700204 -2.046357
H -6.968392 -1.175795 0.891905
H -5.630127 -1.990719 1.705119
H -5.131697 -3.143048 -0.256131
H -6.452565 -2.321867 -1.090991
H -2.656078 -1.735554 0.640737
H -2.511762 -0.076907 1.263981
H -1.676095 0.655913 -1.087014
H -1.668874 -1.059173 -1.552630
H 1.016222 0.003691 1.534318
H -0.699290 0.427892 1.743523
H 1.143312 0.170212 -1.527183
H 0.433113 -1.420647 -1.896852
H 3.733567 2.134595 1.038121
H 2.685191 0.820065 1.556005
H 4.477370 0.854084 -0.705252
H 2.873675 0.899733 -1.427252
H -1.711273 2.267085 0.313908
H 0.932942 -3.362660 -0.276149
H 2.911158 3.972695 -0.305869
H 5.268099 -1.067371 0.503516
H -1.343314 4.557572 -0.551647
H 2.856495 -4.625639 0.666691
H 0.974965 5.410121 -0.876430
H 5.030447 -3.473093 1.045907


%chk=000207626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207626

0 1
N -4.073428 -0.332450 -0.524227
N -0.282282 -0.520284 -0.138430
C -5.239475 0.005130 0.340167
C -4.500739 -1.595945 -1.197625
C -5.741931 -1.348082 0.939608
C -5.395165 -2.391341 -0.171465
C -2.779502 -0.450384 0.203526
C -1.595959 -0.234302 -0.766793
C 0.116636 0.381509 0.988682
C 0.805058 -0.735518 -1.135618
C 0.421945 1.831614 0.590224
C 1.980623 -1.500491 -0.537008
C 1.750198 2.322228 0.385344
C 3.242370 -0.898228 -0.260256
C 3.013917 1.515247 0.679773
C 3.527722 0.582193 -0.485830
C -0.671612 2.716024 0.376611
C 1.787842 -2.874832 -0.240126
C 1.920227 3.659812 -0.066350
C 4.273236 -1.704676 0.296520
C -0.486530 4.040783 -0.069816
C 2.816535 -3.662817 0.314573
C 0.823540 4.513839 -0.306714
C 4.073189 -3.070995 0.583009
H -6.031481 0.446767 -0.296626
H -4.960837 0.753972 1.101038
H -3.621203 -2.172547 -1.531977
H -5.094752 -1.339438 -2.095039
H -6.819875 -1.325653 1.178292
H -5.196005 -1.577461 1.872970
H -4.857255 -3.259042 0.248518
H -6.305148 -2.775626 -0.665687
H -2.639755 -1.433672 0.712722
H -2.773014 0.326010 0.991280
H -1.677390 0.786507 -1.205552
H -1.712982 -0.943427 -1.609090
H 0.992221 -0.086816 1.470732
H -0.702211 0.364492 1.729672
H 1.144545 0.218144 -1.599889
H 0.366317 -1.343567 -1.949464
H 3.818738 2.238184 0.909155
H 2.888786 0.901492 1.590321
H 4.622845 0.711285 -0.567567
H 3.102415 0.939040 -1.441136
H -1.688993 2.360316 0.579227
H 0.804555 -3.316413 -0.441082
H 2.939318 4.039775 -0.214328
H 5.248290 -1.246571 0.505270
H -1.350954 4.696157 -0.224327
H 2.645669 -4.723181 0.532038
H 0.990012 5.540415 -0.652097
H 4.887928 -3.669081 1.006947


