%chk=000183411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183411

0 1
O -3.571468 -2.425042 0.902331
O -3.255831 2.673741 -0.623941
O 5.564954 -0.046666 0.344761
N 0.000506 -0.044308 0.008231
C -0.819310 -1.196516 0.094389
C -0.817621 1.096794 -0.116783
C -2.141090 -0.770227 0.006909
C -2.149601 0.664507 -0.100248
C 1.440437 -0.041302 0.052721
C -0.278972 -2.562421 0.227060
C -0.272096 2.462031 -0.215512
C -3.309924 -1.675103 -0.014605
C -3.309080 1.567693 -0.115033
C 2.170418 0.089765 -1.136461
C 2.093326 -0.168989 1.297240
C -4.123269 -1.661496 -1.279697
C -4.561829 1.098330 0.569389
C 3.566967 0.096518 -1.097723
C 3.478754 -0.167553 1.346708
C 4.207354 -0.032978 0.141944
C 6.428605 0.087760 -0.811442
H -0.029724 -2.999819 -0.751608
H 0.631528 -2.602001 0.843295
H -1.018927 -3.228532 0.708463
H 0.154450 2.806964 0.738185
H 0.511209 2.551403 -0.981052
H -1.076051 3.177935 -0.492661
H 1.651001 0.186030 -2.091815
H 1.506459 -0.266502 2.213191
H -3.707632 -2.381453 -2.000194
H -4.125873 -0.684312 -1.778630
H -5.162265 -1.964961 -1.093532
H -4.358469 0.433312 1.419996
H -5.220062 0.557872 -0.123157
H -5.142102 1.954266 0.944923
H 4.130696 0.199940 -2.019875
H 4.018099 -0.264502 2.288231
H 6.265121 1.053250 -1.298490
H 6.279331 -0.750683 -1.497537
H 7.424583 0.044755 -0.349371


%chk=000183411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183411

0 1
O -3.200071 -2.970895 0.500986
O -3.211960 2.639898 -0.925025
O 5.633924 -0.030515 0.424201
N -0.012120 -0.115641 -0.035323
C -0.808139 -1.263073 0.138778
C -0.818768 1.008506 -0.295249
C -2.154459 -0.868298 -0.021042
C -2.161827 0.574183 -0.277938
C 1.429961 -0.092921 0.049818
C -0.205136 -2.620725 0.340143
C -0.238807 2.384126 -0.434000
C -3.255151 -1.854078 -0.110615
C -3.294237 1.527687 -0.308605
C 2.204747 0.176604 -1.098443
C 2.070749 -0.336102 1.290796
C -4.434086 -1.584712 -1.050584
C -4.549316 1.231481 0.517479
C 3.614208 0.212058 -1.020486
C 3.472417 -0.312494 1.377831
C 4.250112 -0.035596 0.222936
C 6.491815 0.255500 -0.730663
H 0.694624 -2.762998 -0.285286
H 0.092470 -2.782241 1.393844
H -0.956606 -3.391600 0.111002
H 0.570946 2.560465 0.296976
H 0.182491 2.548764 -1.444084
H -1.037098 3.131167 -0.307069
H 1.705180 0.352509 -2.056885
H 1.466989 -0.533604 2.182450
H -4.456581 -2.399131 -1.797872
H -4.367811 -0.622645 -1.579890
H -5.385120 -1.638161 -0.491444
H -4.513770 0.267639 1.046192
H -5.446339 1.273144 -0.125473
H -4.653723 2.039841 1.264727
H 4.194936 0.423381 -1.922639
H 3.987441 -0.496190 2.325093
H 6.286875 1.262237 -1.143079
H 6.365275 -0.506880 -1.523360
H 7.518567 0.216811 -0.339595


