%chk=000291287.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291287

0 1
O 2.580395 2.335983 -0.090336
O 0.148225 -1.439484 1.860511
O 0.699430 1.597261 -1.106469
O -5.164438 0.553376 -0.914354
O -4.833942 -0.494058 1.064586
N -0.648389 -0.549671 -0.093257
C 1.761229 -1.074155 0.133171
C 2.425944 0.024708 -0.433047
C 2.419544 -2.310456 0.213919
C 3.741816 -0.113461 -0.898320
C 0.387236 -1.029647 0.743038
C 3.723096 -2.450716 -0.271757
C 4.386082 -1.351739 -0.824271
C 1.769769 1.354043 -0.590219
C -1.991050 -0.538644 0.344549
C -2.975044 -0.015811 -0.416695
C 2.079094 3.701406 -0.179723
C -4.361938 -0.045229 0.041798
C -6.583395 0.610230 -0.614913
H 1.911225 -3.163834 0.673326
H 4.262503 0.753332 -1.312972
H 4.223780 -3.418515 -0.209166
H 5.407673 -1.455901 -1.192744
H -0.423375 -0.090660 -0.992454
H -2.177099 -0.995983 1.335289
H -2.807518 0.452193 -1.388740
H 1.162356 3.791933 0.412364
H 1.893998 3.960051 -1.226903
H 2.904065 4.279697 0.251238
H -6.743115 1.196975 0.295167
H -6.974653 -0.404588 -0.491708
H -6.994604 1.104862 -1.500408


%chk=000291287-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291287

0 1
O 2.731594 2.401348 -0.432358
O -0.092236 -2.438130 1.031195
O 0.622292 1.619163 -0.906640
O -5.266703 0.909954 -0.562110
O -4.937585 -1.091471 0.606151
N -0.716355 -0.511850 -0.105763
C 1.719644 -1.174147 0.037670
C 2.431753 0.025899 -0.329574
C 2.482076 -2.364905 0.199119
C 3.846423 -0.033268 -0.504151
C 0.243283 -1.407206 0.368780
C 3.873202 -2.410206 -0.003142
C 4.565270 -1.231747 -0.356827
C 1.817664 1.369364 -0.572664
C -2.074345 -0.698249 0.129194
C -3.043956 0.165933 -0.308618
C 2.217867 3.767222 -0.710161
C -4.456797 -0.111368 -0.021200
C -6.718095 0.740467 -0.337056
H 1.933916 -3.257957 0.512849
H 4.371232 0.888965 -0.763091
H 4.410747 -3.355899 0.121978
H 5.649000 -1.242392 -0.511198
H -0.384731 0.343269 -0.602361
H -2.337518 -1.598413 0.695121
H -2.813584 1.074238 -0.874013
H 1.395082 4.008700 -0.017785
H 1.852549 3.832236 -1.748250
H 3.082925 4.423945 -0.546722
H -6.941083 0.718828 0.743542
H -7.071685 -0.200871 -0.791694
H -7.182945 1.612045 -0.819719


