%chk=000182980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182980

0 1
O 0.611025 -1.353880 -0.000019
O 0.581725 0.651055 -1.156245
O 0.581949 0.651392 1.155612
C 2.642814 0.012392 -0.000429
C 4.203300 0.035011 -0.000602
C 2.063461 -1.422011 -0.000152
C 2.031966 0.715758 -1.235641
C 2.032205 0.716172 1.234671
C 0.096640 -0.024923 -0.000177
C 4.743805 -0.680397 -1.253320
C 4.711961 1.489134 -0.000872
C 4.744108 -0.680067 1.252185
C -1.404553 -0.023829 -0.000047
C -2.110207 -1.234868 -0.000167
C -2.085852 1.201495 0.000195
C -3.505048 -1.222110 -0.000063
C -3.481055 1.217258 0.000299
C -4.195265 0.004692 0.000156
C -5.615875 0.018766 0.000310
C -6.822119 0.031345 0.000328
H 2.318958 -1.995075 -0.907074
H 2.319122 -1.994807 0.906892
H 2.265470 1.792290 -1.283573
H 2.285710 0.221605 -2.188273
H 2.286153 0.222361 2.187427
H 2.265686 1.792731 1.282168
H 4.436051 -1.730309 -1.295988
H 5.840267 -0.671283 -1.267620
H 4.411762 -0.200488 -2.179845
H 4.379605 2.043803 -0.884472
H 5.808116 1.521046 -0.001064
H 4.379911 2.044028 0.882702
H 4.412232 -0.199961 2.178671
H 5.840573 -0.670888 1.266261
H 4.436428 -1.729989 1.295174
H -1.560862 -2.180578 -0.000320
H -1.518133 2.134317 0.000321
H -4.061386 -2.158414 -0.000150
H -4.018416 2.164556 0.000492
H -7.855131 0.041469 -0.000648


%chk=000182980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182980

0 1
O 0.580604 -1.413015 0.000108
O 0.537062 0.659672 -1.196209
O 0.537264 0.660328 1.195292
C 2.636690 0.011009 -0.000459
C 4.226636 0.040396 -0.000587
C 2.072477 -1.437758 0.000122
C 2.030034 0.720207 -1.244008
C 2.030237 0.721126 1.242667
C 0.072527 -0.050882 -0.000220
C 4.800738 -0.675456 -1.259285
C 4.759134 1.504159 -0.000430
C 4.800941 -0.675804 1.257822
C -1.437286 -0.056771 -0.000091
C -2.170591 -1.263663 -0.000046
C -2.119757 1.182722 -0.000049
C -3.578678 -1.235029 0.000044
C -3.525974 1.217052 0.000039
C -4.277438 0.005908 0.000088
C -5.713910 0.037381 0.000187
C -6.949099 0.065429 0.000250
H 2.380443 -1.996269 -0.901352
H 2.380442 -1.995526 0.902054
H 2.305601 1.789378 -1.276781
H 2.338257 0.231725 -2.185333
H 2.338767 0.233460 2.184316
H 2.305651 1.790364 1.274505
H 4.514874 -1.741500 -1.302462
H 5.905083 -0.632974 -1.230451
H 4.478344 -0.193879 -2.199469
H 4.438204 2.067314 -0.894800
H 5.864388 1.488571 -0.000777
H 4.438767 2.066922 0.894387
H 4.478227 -0.194842 2.198212
H 5.905268 -0.632804 1.229116
H 4.515567 -1.742002 1.300444
H -1.630588 -2.213765 -0.000074
H -1.542363 2.111553 -0.000070
H -4.150008 -2.168761 0.000085
H -4.056500 2.174477 0.000075
H -8.022936 0.090344 0.000244


