%chk=000184088.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184088

0 1
O -0.281720 0.329840 1.213964
O -1.214159 -1.724517 1.150752
O 5.378588 -0.162488 -2.621170
O 6.218807 -1.640457 -1.284520
N 5.354669 -0.840563 -1.606213
C -2.332034 0.182277 0.025238
C -3.553554 -0.762832 -0.300810
C -2.976245 1.289862 0.928331
C -4.739373 -0.062866 0.429671
C -4.026147 0.451717 1.716903
C -3.897880 2.196892 0.069874
C -5.100875 1.275854 -0.269693
C -1.727869 0.633272 -1.316228
C -3.637433 -0.875681 -1.827048
C -2.701145 0.191075 -2.424583
C -1.275968 -0.563742 0.828839
C 0.856556 -0.201587 1.942107
C 2.017715 -0.378022 1.001639
C 2.101429 0.388640 -0.171393
C 3.030988 -1.296979 1.319482
C 3.188531 0.240172 -1.029648
C 4.124864 -1.451318 0.469261
C 4.197186 -0.680136 -0.701711
H -3.402772 -1.772516 0.143079
H -2.242036 1.841333 1.529073
H -5.598847 -0.723269 0.591434
H -4.671433 1.056628 2.365017
H -3.598202 -0.342296 2.340218
H -3.396393 2.573023 -0.833105
H -4.215922 3.080050 0.645135
H -6.043923 1.682648 0.125270
H -5.236823 1.157004 -1.353772
H -0.732319 0.179961 -1.478625
H -1.565495 1.725268 -1.332226
H -4.671705 -0.750603 -2.189687
H -3.322721 -1.885544 -2.148627
H -2.154453 -0.204453 -3.297109
H -3.284747 1.054301 -2.791053
H 0.567218 -1.146451 2.448400
H 1.056659 0.588369 2.694211
H 1.304196 1.100282 -0.402830
H 2.964376 -1.899507 2.226086
H 3.267665 0.829511 -1.949746
H 4.923244 -2.165250 0.701015


%chk=000184088-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184088

0 1
O -0.217702 0.865297 1.078151
O -0.919069 -1.339133 1.344693
O 6.096047 -0.465793 -2.097825
O 5.322893 -2.601307 -1.889257
N 5.266105 -1.337768 -1.629905
C -2.317284 0.276047 0.047930
C -3.376873 -0.877193 -0.187848
C -3.142352 1.333177 0.886115
C -4.659774 -0.334850 0.526970
C -4.027319 0.387191 1.754294
C -4.223795 2.015657 -0.004195
C -5.276840 0.870081 -0.242247
C -1.810062 0.711716 -1.371503
C -3.420604 -1.120124 -1.720722
C -2.854632 0.167919 -2.383390
C -1.126020 -0.192626 0.880684
C 1.022826 0.541224 1.862274
C 2.130007 0.050797 0.952178
C 3.069195 0.965064 0.407956
C 2.237512 -1.329982 0.634949
C 4.100384 0.521009 -0.442099
C 3.262118 -1.793355 -0.212061
C 4.179478 -0.857130 -0.738257
H -3.055641 -1.793692 0.338894
H -2.497631 2.046721 1.422917
H -5.387803 -1.130634 0.758041
H -4.767810 0.935771 2.364203
H -3.450382 -0.289361 2.409778
H -3.812793 2.425306 -0.942306
H -4.672353 2.861551 0.548703
H -6.259430 1.134018 0.190405
H -5.441276 0.650512 -1.310928
H -0.826454 0.246763 -1.573086
H -1.662169 1.803776 -1.437476
H -4.435811 -1.368387 -2.081663
H -2.769752 -1.979044 -1.972485
H -2.398971 -0.035791 -3.369537
H -3.658792 0.907713 -2.545690
H 0.762228 -0.214132 2.623454
H 1.277797 1.501449 2.336667
H 2.989374 2.030790 0.649993
H 1.502837 -2.028393 1.048126
H 4.835256 1.206811 -0.871346
H 3.365836 -2.850764 -0.468349


