%chk=000233380.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233380

0 1
O -1.093019 -0.648210 -0.529445
O 1.079229 1.325493 -0.975164
O -1.636405 4.602720 1.118618
O 4.503907 -2.403197 -0.425785
O 0.167967 -4.564842 1.711062
O 2.615519 0.101306 -1.879093
C -4.558565 0.283239 -0.228461
C -3.431912 0.098078 0.801534
C -5.708193 -0.699881 0.022722
C -2.325654 1.083019 0.564175
C -1.127852 0.681298 -0.072058
C -6.832464 -0.517641 -1.006962
C -0.089148 1.596367 -0.308177
C 1.305146 -1.057158 -0.231545
C -2.460856 2.417440 0.950052
C 2.291438 -1.926668 0.285781
C -0.046611 -1.406307 -0.019019
C 4.253719 -0.379711 0.851943
C 5.180568 0.435252 -0.062133
C 3.781402 -1.629343 0.150492
C -1.410567 3.319735 0.703254
C -0.213968 2.935790 0.085664
C -7.982683 -1.491943 -0.764160
C 5.741588 1.665543 0.660510
C 1.713167 0.064978 -1.084848
C 1.949463 -3.095252 0.955271
C -0.430863 -2.583448 0.625029
C 0.584807 -3.425103 1.095604
C 6.649471 2.480467 -0.257499
H -4.151618 0.139878 -1.250018
H -4.933513 1.324869 -0.195115
H -3.830641 0.212884 1.830651
H -3.041280 -0.941804 0.740366
H -5.332453 -1.740773 -0.015504
H -6.110891 -0.562389 1.044583
H -6.432170 -0.659924 -2.030313
H -7.210552 0.522992 -0.972742
H -3.368192 2.775672 1.434454
H 3.410881 0.248689 1.200079
H 4.801153 -0.680395 1.772041
H 6.007529 -0.209493 -0.425017
H 4.626432 0.746269 -0.975065
H 0.597208 3.630851 -0.110951
H 4.911599 2.302770 1.024194
H 6.304964 1.353651 1.561612
H -8.428696 -1.352924 0.227119
H -8.779597 -1.354869 -1.503975
H -7.650482 -2.534272 -0.831047
H 2.723439 -3.762127 1.330850
H -1.481680 -2.843648 0.748627
H 7.046615 3.362310 0.256955
H 6.112314 2.832593 -1.146814
H 7.504857 1.891014 -0.608143
H -0.877932 5.206841 0.907758
H 0.924273 -5.139086 2.009455


%chk=000233380-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233380

0 1
O -1.324603 -0.424822 -0.528032
O 0.790293 1.452306 -1.240103
O -1.570099 4.934742 1.199899
O 4.408655 -2.441756 -0.172218
O -0.048209 -4.664778 1.224374
O 2.611489 0.236455 -1.810688
C -4.558617 0.216100 -0.159771
C -3.582049 0.417037 1.033352
C -5.697626 -0.771747 0.174230
C -2.442917 1.365780 0.705730
C -1.327095 0.924678 -0.051694
C -6.691681 -0.965853 -0.993827
C -0.288634 1.811342 -0.389801
C 1.117162 -0.872445 -0.280921
C -2.483007 2.720142 1.104616
C 2.114974 -1.806309 0.154473
C -0.250885 -1.249131 -0.121024
C 4.119141 -0.197826 0.726277
C 5.343034 0.371163 -0.028581
C 3.610610 -1.518523 0.149581
C -1.439356 3.608846 0.758762
C -0.330066 3.161684 0.007388
C -7.815521 -1.972066 -0.664748
C 5.972007 1.577787 0.700537
C 1.563475 0.266729 -1.133420
C 1.744698 -3.066401 0.659765
C -0.624796 -2.507656 0.379199
C 0.377801 -3.424513 0.751089
C 7.175962 2.166526 -0.066506
H -3.987857 -0.154002 -1.033050
H -4.986272 1.197205 -0.448578
H -4.146054 0.807582 1.901438
H -3.177818 -0.571987 1.321516
H -5.261831 -1.755322 0.449637
H -6.249739 -0.414449 1.069110
H -6.136301 -1.309423 -1.890101
H -7.136264 0.014454 -1.260699
H -3.326283 3.100731 1.688234
H 3.311860 0.551994 0.793197
H 4.416362 -0.427505 1.774063
H 6.093998 -0.432653 -0.147770
H 5.021315 0.665812 -1.045163
H 0.488757 3.825065 -0.291344
H 5.204422 2.366184 0.843547
H 6.295024 1.267758 1.716108
H -8.404182 -1.638306 0.210732
H -8.512492 -2.092249 -1.514329
H -7.397704 -2.968628 -0.427066
H 2.539258 -3.761523 0.955856
H -1.681030 -2.772149 0.461672
H 7.616305 3.027650 0.469117
H 6.872382 2.511001 -1.072695
H 7.969827 1.407523 -0.198675
H -0.807764 5.489456 0.900809
H 0.718138 -5.250111 1.447898


