%chk=000196621.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196621

0 1
P -0.356362 -1.568504 -1.201873
O 1.345409 -1.362604 -1.073157
O -0.976269 -0.140729 -0.550977
N -0.625000 -2.795854 0.049516
C -1.776258 -3.718777 -0.220157
C 0.517351 -3.457391 0.762082
C -1.604169 -4.618913 -1.457032
C -3.096184 -2.937092 -0.293480
C 1.268926 -2.447416 1.638355
C 1.492026 -4.197138 -0.169698
C 1.885444 -0.359384 -1.963202
C -0.767385 0.193685 0.841293
C 2.219976 0.875092 -1.161620
C -1.480205 1.504124 1.060278
C 1.270087 1.891552 -0.990039
C -1.159384 2.278050 2.186266
C 3.490964 1.006393 -0.583509
C -2.462181 1.949015 0.164694
C 1.593384 3.034165 -0.252986
C -1.823500 3.486332 2.412436
C 3.812018 2.152522 0.149321
C -3.119743 3.160277 0.394051
C 2.865037 3.168590 0.313352
C -2.803513 3.929925 1.518158
H -1.837103 -4.395568 0.682304
H 0.048458 -4.221842 1.447276
H -2.330808 -5.437682 -1.443776
H -1.753723 -4.083635 -2.400241
H -0.599104 -5.066271 -1.488442
H -3.158949 -2.179909 0.500263
H -3.948193 -3.613985 -0.169156
H -3.243893 -2.417375 -1.246740
H 1.996974 -2.958447 2.276327
H 1.832025 -1.714851 1.037481
H 0.585269 -1.892781 2.288824
H 0.960137 -4.850492 -0.874787
H 2.188791 -4.816199 0.402320
H 2.099882 -3.495469 -0.760370
H 1.225937 -0.127022 -2.819841
H 2.799372 -0.854784 -2.355444
H 0.320908 0.288681 1.033010
H -1.203397 -0.598411 1.484103
H 0.265120 1.781687 -1.407163
H -0.393818 1.942564 2.882287
H 4.227155 0.213080 -0.699516
H -2.698402 1.341336 -0.711478
H 0.847320 3.816058 -0.114700
H -1.575969 4.084258 3.287379
H 4.800017 2.252651 0.594014
H -3.880738 3.503870 -0.304010
H 3.115910 4.060662 0.883346
H -3.318149 4.870955 1.696960


%chk=000196621-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196621

0 1
P -0.364925 -1.538270 -1.377184
O 1.386166 -1.274679 -1.106250
O -1.045715 -0.042509 -0.647757
N -0.560401 -2.812684 -0.158446
C -1.849341 -3.589314 -0.239030
C 0.502518 -3.424670 0.713600
C -1.749889 -4.814517 -1.185029
C -3.066677 -2.709533 -0.610717
C 1.080302 -2.439717 1.755875
C 1.636965 -4.125514 -0.080231
C 2.047667 -0.315127 -2.040303
C -0.908597 0.290321 0.777562
C 2.579788 0.888918 -1.289650
C -1.777696 1.492596 1.105145
C 1.710085 1.942179 -0.902950
C -1.485682 2.271395 2.254172
C 3.955418 0.977123 -0.959939
C -2.894206 1.837729 0.305374
C 2.208021 3.058447 -0.196499
C -2.304982 3.366887 2.607665
C 4.457107 2.095237 -0.254580
C -3.711471 2.936827 0.655971
C 3.583558 3.138880 0.128743
C -3.423671 3.702883 1.809438
H -2.025733 -3.962259 0.790833
H -0.039506 -4.213646 1.276505
H -2.696503 -5.387407 -1.182035
H -1.547995 -4.483132 -2.220683
H -0.937740 -5.495300 -0.875992
H -3.139471 -1.823959 0.043420
H -3.990976 -3.305631 -0.499924
H -3.021581 -2.360713 -1.658973
H 1.793917 -2.971942 2.412685
H 1.615055 -1.616554 1.254718
H 0.278832 -2.020316 2.389756
H 1.226565 -4.835665 -0.819594
H 2.290147 -4.687423 0.614417
H 2.244236 -3.376111 -0.611751
H 1.329565 -0.004942 -2.826587
H 2.871835 -0.878128 -2.514940
H 0.152473 0.506029 1.013485
H -1.216984 -0.590790 1.380573
H 0.643565 1.876674 -1.150916
H -0.612582 2.023772 2.871737
H 4.634835 0.167662 -1.254942
H -3.095378 1.248773 -0.594570
H 1.524625 3.863135 0.097354
H -2.068108 3.960121 3.498485
H 5.523196 2.153052 -0.007204
H -4.571288 3.196914 0.027505
H 3.970341 4.007215 0.674242
H -4.058183 4.554680 2.079718


