%chk=000215159.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215159

0 1
O 0.549355 -2.123368 0.160339
O 1.402817 2.875288 0.125441
O -1.158897 4.074453 -0.495344
O 3.127450 -3.311416 0.785744
O -1.543212 -2.413267 -0.317740
O 3.518926 3.133569 0.584050
N -5.211342 -1.361949 0.296286
C 0.330554 0.693673 -0.014928
C -0.829585 -0.090350 -0.236352
C -2.050499 0.557990 -0.532110
C 1.598149 0.055557 0.295273
C -3.318935 -0.204597 -0.760391
C 0.286060 2.085597 -0.086900
C 1.663430 -1.338070 0.372943
C 2.753420 0.836335 0.517138
C -2.088881 1.958408 -0.602931
C -4.064411 -0.436308 0.572323
C -0.943671 2.739762 -0.388065
C -0.722268 -1.545311 -0.157155
C 2.897764 -1.977501 0.675273
C 2.668545 2.295808 0.432421
C 3.969880 0.204413 0.816238
C 4.042501 -1.184333 0.894693
C -6.308995 -1.156147 1.287313
C -4.760175 -2.785506 0.309475
C -0.032880 4.978941 -0.294962
C 2.012203 -4.224641 0.568890
H -3.992404 0.320804 -1.470184
H -3.120442 -1.188044 -1.250688
H -3.027359 2.470988 -0.829844
H -4.446951 0.535074 0.951288
H -3.361567 -0.826701 1.339238
H 4.864954 0.811747 0.987901
H 4.985183 -1.684515 1.126309
H -7.141725 -1.835200 1.040724
H -6.027614 -1.327081 2.336350
H -6.693993 -0.128661 1.189182
H -3.853870 -2.897378 -0.315221
H -4.526177 -3.188217 1.305255
H -5.550072 -3.405059 -0.142943
H 0.362860 4.866164 0.720573
H -0.507144 5.955670 -0.445140
H 0.744707 4.781235 -1.041278
H 2.493920 -5.198015 0.716812
H 1.624733 -4.109106 -0.449512
H 1.225858 -4.038834 1.308814


%chk=000215159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215159

0 1
O 0.625381 -2.138852 0.188094
O 1.430515 2.889921 0.128520
O -1.173139 4.075050 -0.566588
O 3.250264 -3.311096 0.864007
O -1.565432 -2.470926 -0.316873
O 3.646275 3.169604 0.644068
N -5.341630 -1.265180 0.375705
C 0.366299 0.670698 -0.005473
C -0.797995 -0.140091 -0.230397
C -2.042376 0.496101 -0.560042
C 1.649518 0.075411 0.324450
C -3.349665 -0.246400 -0.773252
C 0.299903 2.082346 -0.098862
C 1.750698 -1.333191 0.416044
C 2.801753 0.885689 0.555124
C -2.063777 1.900988 -0.651220
C -4.042252 -0.587735 0.578794
C -0.928577 2.721151 -0.429374
C -0.685123 -1.604526 -0.142951
C 2.990914 -1.958154 0.737278
C 2.728107 2.347192 0.465632
C 4.036608 0.267940 0.875316
C 4.124459 -1.126443 0.963704
C -6.239470 -1.125497 1.540552
C -5.204075 -2.677681 -0.041128
C -0.126172 5.113674 -0.417205
C 2.219417 -4.358416 0.671707
H -4.047078 0.383706 -1.352522
H -3.178933 -1.179670 -1.331782
H -2.996737 2.414063 -0.904326
H -4.231791 0.357749 1.122243
H -3.344988 -1.197733 1.204753
H 4.911752 0.900102 1.050034
H 5.066247 -1.625095 1.209089
H -7.225750 -1.562303 1.300228
H -5.857716 -1.632015 2.463852
H -6.388361 -0.055828 1.773089
H -4.586021 -2.753942 -0.950270
H -4.728725 -3.317905 0.743450
H -6.202887 -3.090701 -0.270232
H 0.293883 5.108425 0.600481
H -0.664249 6.052794 -0.613607
H 0.683695 4.966535 -1.148707
H 2.766639 -5.296019 0.849073
H 1.813015 -4.330080 -0.351303
H 1.397779 -4.241758 1.395426


