%chk=000256791.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256791

0 1
O 1.630705 -2.091771 -0.457156
O 4.345407 0.658600 -0.745827
O 0.006337 -1.982936 1.128304
O 4.031681 -0.480808 1.195025
O -6.234616 1.291588 -1.044404
O -6.372532 -0.225063 0.594196
N 0.011134 1.005001 0.096279
N 0.622628 2.234117 -0.020791
N 1.906214 2.095363 0.033506
C 1.007066 0.021276 0.229512
C -1.428322 0.861559 0.051184
C 2.218729 0.734357 0.184171
C -2.076887 -0.006917 0.941223
C -2.144873 1.630592 -0.882963
C 0.785844 -1.435036 0.385082
C -4.192691 0.635791 -0.054526
C -3.466163 -0.119846 0.879888
C -3.533492 1.512658 -0.930371
C 3.603509 0.226245 0.314064
C 1.636977 -3.564287 -0.410589
C 5.774075 0.315780 -0.759973
C -5.664998 0.483280 -0.083815
C 0.422024 -4.106262 -1.126823
C 6.520870 1.198120 0.215128
H -1.510809 -0.597869 1.674897
H -1.624862 2.319268 -1.554802
H -3.994610 -0.795732 1.562535
H -4.115006 2.101369 -1.648780
H 2.589606 -3.766085 -0.936532
H 1.694482 -3.877327 0.647114
H 5.879073 -0.760130 -0.536513
H 6.014256 0.528261 -1.818712
H 0.306891 -3.664677 -2.125862
H -0.503133 -3.896458 -0.568385
H 0.485356 -5.195010 -1.252781
H 7.606523 1.105813 0.092770
H 6.258619 2.257326 0.081053
H 6.282234 0.938359 1.257763
H -7.226946 1.200290 -1.071791


%chk=000256791-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256791

0 1
O 1.386221 -2.173297 -0.776166
O 4.554176 1.143209 -0.725456
O 0.489631 -1.852922 1.358260
O 3.913710 -0.853749 0.314797
O -6.348919 1.327129 -0.819121
O -6.287143 -0.234202 0.899975
N 0.039071 0.947233 -0.225202
N 0.582548 2.237809 -0.587884
N 1.905969 2.096873 -0.624430
C 1.069786 0.042846 -0.065051
C -1.387808 0.813112 -0.139727
C 2.247530 0.776394 -0.315900
C -1.986146 -0.037453 0.823046
C -2.179728 1.593302 -1.019337
C 0.937172 -1.406047 0.274725
C -4.193551 0.640350 -0.005744
C -3.389212 -0.124291 0.876721
C -3.580630 1.505413 -0.948638
C 3.628352 0.259396 -0.199514
C 1.471362 -3.656061 -0.540629
C 5.993533 0.746026 -0.602797
C -5.671855 0.509548 0.098884
C 0.138822 -4.331103 -0.870111
C 6.555899 1.180630 0.753036
H -1.368343 -0.606522 1.522941
H -1.690231 2.255699 -1.737395
H -3.879557 -0.773325 1.608984
H -4.208421 2.096464 -1.620131
H 2.280730 -3.966897 -1.218858
H 1.768751 -3.818618 0.509336
H 6.070766 -0.346490 -0.742863
H 6.472718 1.275757 -1.440832
H -0.178735 -4.098161 -1.900845
H -0.651101 -4.013209 -0.169594
H 0.252874 -5.427582 -0.784883
H 7.640430 0.967821 0.789592
H 6.410155 2.263068 0.908826
H 6.069789 0.631001 1.576339
H -7.328314 1.199649 -0.702054


