%chk=000233786.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233786

0 1
O 4.389813 2.094299 0.804454
O 4.907204 -0.059380 -2.067573
N 2.405567 0.058386 -0.239779
N -2.184806 0.824777 0.566072
N -1.530979 2.002585 0.210917
N -0.281508 1.791371 0.010477
N 1.040057 -1.738856 0.439962
N -1.409871 -1.541371 0.847686
N -0.244414 -3.566737 1.179803
C -3.644950 0.738865 0.780160
C 1.169143 -0.397162 0.128968
C -4.363021 0.314272 -0.509442
C -0.005215 0.421944 0.196303
C -1.252415 -0.219909 0.557188
C 2.646891 1.461277 -0.658901
C 3.625115 -0.780511 -0.094885
C -5.879069 0.241033 -0.288879
C 2.993146 2.360533 0.531386
C 4.212141 -1.157828 -1.462092
C -0.206988 -2.235000 0.797593
C -6.607118 -0.179461 -1.563047
H -3.829284 -0.001068 1.595915
H -4.009459 1.732923 1.130302
H -4.129469 1.025285 -1.327203
H -3.978912 -0.669946 -0.848416
H 3.499074 1.461928 -1.393781
H 1.763036 1.866081 -1.206708
H 4.371774 -0.197777 0.504238
H 3.393898 -1.705662 0.487193
H -6.261290 1.224143 0.050954
H -6.109147 -0.475342 0.524941
H 2.397354 2.127050 1.431863
H 2.877195 3.428517 0.272659
H 3.430767 -1.396542 -2.210798
H 4.908973 -2.010941 -1.370746
H -7.689955 -0.231138 -1.401489
H -6.431631 0.527961 -2.382128
H -6.279970 -1.167103 -1.908982
H -1.141325 -4.019476 1.277425
H 0.552524 -4.153584 0.986214
H 4.694220 2.641215 1.552394
H 5.575703 0.310547 -1.451817


%chk=000233786-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233786

0 1
O 4.480914 1.737613 0.852669
O 5.480048 0.303007 -1.245675
N 2.392893 -0.016868 -0.393921
N -2.167738 0.912979 0.390493
N -1.520404 2.127358 0.006400
N -0.224638 1.838145 -0.208257
N 0.930354 -1.721667 0.330129
N -1.489064 -1.426544 0.740348
N -0.426240 -3.496427 0.997093
C -3.608210 0.884052 0.665903
C 1.127364 -0.411106 -0.021398
C -4.424178 0.257092 -0.486948
C -0.021228 0.467334 0.022829
C -1.262673 -0.126243 0.408662
C 2.674862 1.391454 -0.753604
C 3.520047 -0.983628 -0.270434
C -5.935276 0.226984 -0.166554
C 3.154230 2.248235 0.425874
C 4.600220 -0.862913 -1.359414
C -0.327508 -2.161284 0.675994
C -6.766410 -0.401490 -1.305792
H -3.767933 0.308258 1.596482
H -3.915150 1.929748 0.841237
H -4.246447 0.836749 -1.413622
H -4.058824 -0.772203 -0.666814
H 3.438733 1.406943 -1.548430
H 1.753100 1.856344 -1.136425
H 3.991658 -0.862302 0.725870
H 3.068687 -1.988662 -0.302021
H -6.293567 1.258867 0.026569
H -6.100839 -0.343632 0.770125
H 2.435852 2.188778 1.265225
H 3.239731 3.301216 0.089995
H 4.128878 -0.841754 -2.362393
H 5.224783 -1.778604 -1.300130
H -7.843878 -0.413034 -1.059627
H -6.640223 0.164946 -2.247375
H -6.451298 -1.444376 -1.496955
H -1.331057 -3.874726 1.262252
H 0.406491 -4.076677 0.963600
H 4.867319 2.305830 1.561120
H 5.289418 0.802406 -0.394678


