%chk=000232638.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232638

0 1
O 3.927131 0.084092 0.137478
O -2.204634 -0.213977 -1.291425
O -2.245257 1.764654 -0.202018
N -5.844958 -0.530106 -0.621268
N 2.821926 2.435018 0.836168
C -6.660856 -1.362645 0.315474
C -4.399598 -0.465627 -0.261469
C 6.085744 -0.801891 0.110363
C -3.637321 -0.116121 -1.547150
C -8.075103 -1.469667 -0.272009
C -6.710740 -0.805841 1.748461
C 4.652936 -1.103792 -0.319902
C 7.032746 -1.935014 -0.302141
C 2.582416 0.163102 -0.126553
C -0.150507 0.568034 -0.456364
C 1.996815 1.391288 0.333131
C 8.468531 -1.642934 0.125083
C 0.624787 1.571176 0.163182
C 1.815203 -0.820287 -0.745556
C 0.438692 -0.611212 -0.912601
C -1.600517 0.819692 -0.601926
H -6.199240 -2.385423 0.339721
H -4.167085 0.283271 0.528477
H -4.049379 -1.449074 0.120370
H -6.227408 0.419672 -0.681460
H 6.123074 -0.642302 1.206791
H 6.412992 0.160861 -0.333874
H -3.870004 0.895186 -1.920312
H -3.772654 -0.869897 -2.344092
H -8.604654 -0.511533 -0.256343
H -8.037891 -1.802706 -1.318005
H -8.679229 -2.191159 0.286596
H -7.120179 0.209124 1.780004
H -5.716900 -0.772691 2.205893
H -7.343387 -1.427289 2.390979
H 4.227024 -1.987237 0.183728
H 4.539863 -1.182606 -1.414198
H 6.698066 -2.891865 0.145814
H 6.993730 -2.081028 -1.400254
H 8.554137 -1.529933 1.212212
H 9.142888 -2.454385 -0.173093
H 8.847535 -0.720079 -0.330058
H 0.136515 2.491446 0.495710
H 2.258980 -1.745193 -1.101276
H -0.174051 -1.374866 -1.398862
H 2.383582 3.005709 1.548246
H 3.741540 2.124053 1.135230


%chk=000232638-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232638

0 1
O 4.017650 0.224339 0.162729
O -2.222306 -0.323398 -1.291053
O -2.230660 1.807061 -0.333039
N -5.914120 -0.547351 -0.560502
N 2.775853 2.460682 0.920123
C -6.841876 -1.352154 0.276937
C -4.470156 -0.688801 -0.284810
C 6.236005 -0.750193 0.124703
C -3.687271 -0.202077 -1.517427
C -8.271724 -1.196904 -0.280465
C -6.790918 -1.006384 1.791603
C 4.768263 -0.979357 -0.240830
C 7.123312 -1.956729 -0.262819
C 2.633738 0.252882 -0.087146
C -0.140037 0.555026 -0.484175
C 1.997302 1.469910 0.331616
C 8.607384 -1.734700 0.098829
C 0.606706 1.599370 0.123056
C 1.893154 -0.784953 -0.688173
C 0.502998 -0.639844 -0.889756
C -1.597674 0.771543 -0.670117
H -6.533228 -2.410790 0.153851
H -4.113606 -0.131870 0.611412
H -4.252915 -1.760438 -0.116695
H -6.203428 0.441121 -0.593271
H 6.312809 -0.561775 1.213004
H 6.597555 0.161778 -0.388457
H -3.929883 0.852937 -1.741446
H -3.896635 -0.837840 -2.390770
H -8.610842 -0.145114 -0.199767
H -8.302693 -1.486992 -1.344781
H -8.986541 -1.823842 0.282454
H -7.131515 0.033300 1.963387
H -5.764714 -1.101537 2.191191
H -7.446155 -1.681175 2.374126
H 4.356797 -1.862212 0.291290
H 4.648908 -1.135525 -1.333180
H 6.751001 -2.868590 0.246996
H 7.033264 -2.147296 -1.351669
H 8.730729 -1.570951 1.185745
H 9.224824 -2.606491 -0.183955
H 9.014315 -0.848302 -0.422806
H 0.079020 2.510756 0.425573
H 2.388129 -1.708426 -1.002534
H -0.080621 -1.436207 -1.356561
H 2.362915 3.335268 1.226698
H 3.772189 2.300243 1.037785


