%chk=000270951.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270951

0 1
O -0.804710 -1.555147 0.148816
N -2.201007 -0.246447 -1.156337
N 0.065096 0.389478 -0.797596
C -4.120771 -0.360269 0.484072
C -3.393238 -1.011769 -0.699846
C -4.902325 0.897914 0.086179
C -5.636213 1.503874 1.280076
C 1.432828 0.243974 -0.392821
C -0.963526 -0.549180 -0.521374
C 4.129780 0.114129 0.376487
C 2.353692 1.188562 -0.889449
C 1.862674 -0.767231 0.484669
C 3.691551 1.117163 -0.500204
C 3.202379 -0.823909 0.861098
C 5.562071 0.032508 0.794546
H -3.396566 -0.123367 1.289485
H -4.812036 -1.102725 0.931809
H -4.068283 -1.114107 -1.578882
H -3.067418 -2.044409 -0.419900
H -5.629816 0.652203 -0.712910
H -4.217722 1.651702 -0.347887
H -2.403503 0.723689 -1.393468
H -4.942689 1.788818 2.080035
H -6.190218 2.404105 0.990745
H -6.358220 0.800457 1.711184
H -0.114638 1.136089 -1.469970
H 2.036225 1.972987 -1.571095
H 1.152267 -1.509302 0.866494
H 4.398371 1.850277 -0.885821
H 3.531865 -1.609444 1.540748
H 5.662923 0.102788 1.886939
H 6.011800 -0.922111 0.485820
H 6.176678 0.832200 0.362658


%chk=000270951-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270951

0 1
O -0.836573 -1.636883 0.345248
N -2.198828 -0.224093 -0.924401
N 0.089654 0.247567 -0.746677
C -4.310610 -0.390060 0.461800
C -3.420612 -0.997610 -0.648476
C -4.884002 1.003525 0.117939
C -5.815884 1.551256 1.220890
C 1.456395 0.162202 -0.359592
C -0.967321 -0.608337 -0.386007
C 4.239272 0.130459 0.333233
C 2.342287 1.152106 -0.862066
C 1.969236 -0.850874 0.495227
C 3.709811 1.131545 -0.518612
C 3.339402 -0.850179 0.825811
C 5.712178 0.102631 0.705116
H -3.723654 -0.335115 1.399152
H -5.148957 -1.091941 0.650369
H -4.000537 -1.091739 -1.588206
H -3.087705 -2.005763 -0.347722
H -5.439860 0.945167 -0.841345
H -4.050114 1.718257 -0.039594
H -2.286274 0.642936 -1.455231
H -5.277686 1.641071 2.182999
H -6.212499 2.549492 0.959564
H -6.676901 0.875496 1.380995
H -0.128911 1.022339 -1.376559
H 1.961996 1.942193 -1.523987
H 1.291923 -1.615325 0.879912
H 4.373299 1.907002 -0.920287
H 3.718593 -1.639751 1.487198
H 5.853590 0.159644 1.801024
H 6.197669 -0.831689 0.364419
H 6.258925 0.947972 0.252168


