%chk=000277905.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000277905

0 1
S 2.954790 0.824445 -0.308159
O 3.874599 0.903922 -1.429071
O 3.272611 1.531503 0.907056
N 1.504114 1.498026 -1.010681
N 0.442143 1.473229 -0.148950
C -1.750707 1.957892 0.667130
C 2.560427 -0.810913 0.024766
C -2.974314 1.307781 0.078383
C -0.661465 2.133652 -0.367435
C 2.999732 -1.823090 -0.838142
C 1.805301 -1.139329 1.156886
C 1.937809 -3.489843 0.568825
C 2.693081 -3.155978 -0.570176
C 1.494184 -2.471658 1.430133
C -4.209732 1.970545 0.100879
C -2.883254 0.024457 -0.484269
C -0.952190 3.046328 -1.517581
C 1.596036 -4.914096 0.852214
C -5.344458 1.351542 -0.432775
C -4.019391 -0.587113 -1.017369
C -5.252630 0.074075 -0.992308
H -1.386684 1.343851 1.524484
H -1.986070 2.950568 1.107438
H 3.591975 -1.566524 -1.725450
H 1.456107 -0.349090 1.831850
H 1.552685 2.191556 -1.770089
H 3.039150 -3.937745 -1.243323
H 0.907187 -2.720239 2.312037
H -4.291304 2.964769 0.534346
H -1.921758 -0.488213 -0.506712
H -0.310124 3.937727 -1.499397
H -0.804454 2.539984 -2.482943
H -1.993933 3.399049 -1.512817
H 0.624112 -5.176556 0.405160
H 1.519730 -5.121523 1.928986
H 2.336672 -5.615831 0.443819
H -6.302506 1.868457 -0.411601
H -3.945199 -1.581687 -1.454139
H -6.136470 -0.405130 -1.407209


%chk=000277905-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000277905

0 1
S 2.961054 0.848917 -0.113489
O 4.063488 1.070169 -1.290619
O 3.093137 1.577276 1.334444
N 1.321533 1.341652 -1.018697
N 0.267779 1.412863 -0.124201
C -1.942536 2.097275 0.574413
C 2.674774 -0.980848 0.169007
C -3.237615 1.512839 0.006490
C -0.802645 2.121952 -0.428930
C 2.999026 -1.868953 -0.868025
C 2.182004 -1.387335 1.418350
C 2.304717 -3.716952 0.612798
C 2.810216 -3.247709 -0.629400
C 2.001278 -2.771885 1.628799
C -4.449015 2.246840 0.047956
C -3.247095 0.213473 -0.565058
C -0.945192 2.915269 -1.713554
C 2.078704 -5.199620 0.844583
C -5.647104 1.696774 -0.464734
C -4.440995 -0.338184 -1.078999
C -5.646514 0.401895 -1.030736
H -1.601677 1.511099 1.447208
H -2.135437 3.130372 0.926518
H 3.403448 -1.495640 -1.814209
H 1.967720 -0.648611 2.196544
H 1.573658 2.193140 -1.570794
H 3.062353 -3.967283 -1.416624
H 1.620901 -3.121655 2.595323
H -4.456638 3.251844 0.488587
H -2.314074 -0.361979 -0.603046
H -0.189129 3.726433 -1.774351
H -0.799252 2.267085 -2.599372
H -1.943063 3.374493 -1.785662
H 1.042100 -5.484660 0.579363
H 2.232319 -5.473360 1.902880
H 2.756489 -5.815212 0.228476
H -6.575977 2.276916 -0.422674
H -4.433861 -1.343560 -1.515509
H -6.573078 -0.026331 -1.429259


