%chk=000234638.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234638

0 1
O -3.784725 1.165033 0.283833
O -1.875344 -2.176734 -1.000294
O -1.981166 2.354819 -0.107553
O 3.541079 -2.536611 0.582162
O 1.654154 -2.126324 -0.385097
N 0.687639 0.403339 0.368778
N 2.712549 -1.774590 0.109806
C -1.629568 -0.060255 0.124824
C -0.237767 0.098759 -0.478666
C -2.424388 -1.263873 -0.441266
C -2.374597 1.239479 0.057193
C -3.854583 -1.175060 -0.172700
C -4.467764 -0.029794 0.180547
C -0.102210 -0.107172 -1.944933
C 2.051286 0.668836 0.123338
C 3.040717 -0.339671 0.107735
C -5.898425 0.197333 0.476642
C 2.456363 2.025784 0.065037
C 4.408556 0.012335 0.096049
C 3.804006 2.352217 0.026630
C 4.787136 1.345114 0.048014
H -1.499400 -0.306727 1.231506
H -4.411011 -2.106278 -0.301798
H 0.820377 0.320130 -2.360817
H -0.943550 0.292221 -2.524271
H -0.061924 -1.203337 -2.149674
H -6.234722 -0.402099 1.339362
H -6.539446 -0.075244 -0.378794
H -6.109974 1.256562 0.714244
H 1.693791 2.807141 0.072100
H 5.159982 -0.785491 0.123612
H 4.108852 3.400256 -0.016330
H 5.841778 1.616403 0.031078


%chk=000234638-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234638

0 1
O -3.801989 1.137734 0.450909
O -1.944023 -2.077951 -1.395455
O -1.966919 2.401122 -0.102728
O 3.833147 -2.642004 0.954800
O 1.675380 -2.348573 0.269258
N 0.715299 0.123893 0.294028
N 2.863643 -1.901011 0.517600
C -1.650017 -0.052642 -0.015251
C -0.246563 0.159692 -0.577869
C -2.484318 -1.192121 -0.679851
C -2.414780 1.262816 0.068551
C -3.904741 -1.174651 -0.326465
C -4.499986 -0.074732 0.236160
C -0.103743 0.372109 -2.067512
C 2.062106 0.453552 0.093127
C 3.134588 -0.471731 0.290873
C -5.934266 0.063132 0.642781
C 2.414850 1.819698 -0.131713
C 4.487259 -0.056523 0.269698
C 3.758987 2.228120 -0.166742
C 4.805473 1.291275 0.035896
H -1.519264 -0.389638 1.038135
H -4.503805 -2.057442 -0.559717
H 0.936453 0.600605 -2.346941
H -0.755521 1.197365 -2.408716
H -0.422575 -0.549404 -2.588103
H -6.003214 0.328798 1.713541
H -6.484821 -0.874043 0.469393
H -6.419249 0.879250 0.076826
H 1.605712 2.547851 -0.251420
H 5.259224 -0.812758 0.435332
H 3.994405 3.282210 -0.349009
H 5.850969 1.612506 0.010877


