%chk=000267610.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267610

0 1
O -4.563292 0.124053 -1.853503
O -6.053229 0.784390 2.408018
O -7.765619 0.679031 0.966405
O -3.831062 -3.372785 1.399682
O -5.102641 -3.585867 -0.433812
O 6.992783 1.558847 0.507340
N -4.389151 -0.088156 0.403738
N 1.330499 2.579102 -1.019112
N 4.384022 1.190940 -0.656449
N 5.214587 -2.139900 0.711290
N 3.246022 -1.394925 -0.398113
N 7.071793 -0.639351 1.135184
N 7.123721 -2.853053 1.976907
C -5.732192 -0.664901 0.526779
C -5.719915 -1.980456 1.325365
C -2.522625 0.887553 -0.846222
C 0.071481 1.960882 -0.962188
C 2.423755 2.031104 -1.846442
C -3.886603 0.304947 -0.857519
C 3.160177 0.906053 -1.149255
C -1.673194 0.576679 -1.922823
C -2.077052 1.766187 0.155512
C -0.383683 1.091464 -1.981487
C -0.794379 2.294840 0.112285
C -6.656029 0.320786 1.260164
C 5.067104 0.202335 -0.033217
C 4.500682 -1.101704 0.090361
C 2.586957 -0.394578 -1.010441
C -4.915999 -3.033962 0.619806
C 6.439304 0.495519 0.538011
C 6.505117 -1.823757 1.246852
H -6.162214 -0.836038 -0.514223
H -5.321972 -1.813294 2.355328
H -6.760568 -2.357850 1.460154
H -3.859078 0.023307 1.264375
H 2.036080 1.685074 -2.833909
H 3.133243 2.872190 -2.070184
H 1.653115 3.056596 -0.175433
H -2.040788 -0.076624 -2.721461
H -2.743808 2.047708 0.973529
H 0.251577 0.859015 -2.832787
H -0.463377 2.977657 0.891060
H 1.580295 -0.624158 -1.393044
H 4.754254 -3.041087 0.856937
H -6.616875 1.443211 2.898239
H -3.261948 -4.075246 0.983853
H 8.067852 -2.639058 2.304739
H 7.023774 -3.803620 1.646411


%chk=000267610-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267610

0 1
O -3.794497 -1.130325 -1.539081
O -6.494545 1.198049 -0.647471
O -8.117550 -0.346151 -0.043480
O -5.036941 -2.653712 3.579768
O -4.815872 -3.493106 1.424611
O 5.465922 0.832272 2.449099
N -4.464178 -0.175265 0.471359
N 1.417930 2.573296 -0.364111
N 4.020897 1.226975 -0.016150
N 5.805194 -1.933820 -0.588217
N 4.375402 -0.749209 -2.039183
N 6.353160 -1.177778 1.639071
N 7.235674 -3.176590 0.825524
C -5.748740 -0.861862 0.440281
C -6.144856 -1.445391 1.818189
C -2.260971 0.413444 -0.461286
C 0.232565 1.835385 -0.419664
C 2.469290 2.532759 -1.386009
C -3.539520 -0.350993 -0.566483
C 3.388067 1.324415 -1.223640
C -1.440114 0.488994 -1.615763
C -1.800561 1.048195 0.726212
C -0.218723 1.180915 -1.606118
C -0.582893 1.743988 0.750562
C -6.913764 -0.008534 -0.089494
C 4.828638 0.155261 0.201844
C 4.987751 -0.829538 -0.825756
C 3.576329 0.337763 -2.228560
C -5.269180 -2.623908 2.196473
C 5.558938 -0.010054 1.518971
C 6.451995 -2.059299 0.649783
H -5.624757 -1.693953 -0.284953
H -6.103123 -0.683512 2.615252
H -7.191818 -1.800276 1.758593
H -4.351608 0.612817 1.109635
H 2.023282 2.554779 -2.394494
H 3.078155 3.448615 -1.279018
H 1.740178 2.852520 0.564921
H -1.786512 -0.020815 -2.521012
H -2.367827 0.971545 1.661913
H 0.378198 1.212950 -2.522742
H -0.240947 2.214620 1.680451
H 3.077728 0.410895 -3.200449
H 5.889655 -2.620274 -1.343516
H -7.284376 1.675914 -1.021470
H -4.494625 -3.459194 3.802286
H 7.701236 -3.261468 1.726832
H 7.353217 -3.902239 0.123191


