%chk=000282268.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282268

0 1
S -0.000153 0.763481 0.004187
O -0.328119 1.515248 -1.197651
O 0.327544 1.505170 1.212345
N 3.755283 -0.709672 -0.099898
N -3.755002 -0.712143 0.095512
C 1.337511 -0.319085 -0.376128
C -1.337418 -0.322761 0.375336
C 2.680093 0.334888 -0.017500
C -2.680204 0.333458 0.021634
C 4.901950 -0.353821 0.788426
C 4.226991 -0.889454 -1.505165
C -4.901869 -0.349330 -0.789729
C -4.226531 -0.903668 1.499284
H 1.279843 -1.293659 0.154283
H 1.338348 -0.602736 -1.448763
H -1.279141 -1.292990 -0.162910
H -1.338414 -0.615078 1.445648
H 2.870040 1.210337 -0.677035
H 2.632778 0.729102 1.027735
H -2.870653 1.203597 0.688017
H -2.632850 0.735926 -1.020449
H 4.546954 -0.302981 1.830982
H 5.401662 0.595155 0.545001
H 5.652300 -1.159754 0.744420
H 4.946408 -1.723727 -1.535293
H 4.706608 -0.004778 -1.949759
H 3.374600 -1.174424 -2.141467
H -5.401622 0.597626 -0.538648
H -5.652145 -1.155648 -0.752047
H -4.547034 -0.290136 -1.831900
H -3.374008 -1.193705 2.133116
H -4.945754 -1.738325 1.522577
H -4.706298 -0.022811 1.951238


%chk=000282268-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282268

0 1
S 0.000265 0.685981 0.006703
O -0.290028 1.503443 -1.387474
O 0.291176 1.491831 1.407467
N 3.961681 -0.633560 -0.100530
N -3.960793 -0.636305 0.095428
C 1.513082 -0.498746 -0.307936
C -1.513012 -0.500881 0.311540
C 2.801586 0.282463 -0.020515
C -2.801314 0.281407 0.026262
C 5.093171 -0.204472 0.749813
C 4.384766 -0.920366 -1.487754
C -5.090172 -0.201272 -0.754703
C -4.387735 -0.934670 1.479031
H 1.389130 -1.340681 0.392061
H 1.374436 -0.808388 -1.355317
H -1.387651 -1.338620 -0.393251
H -1.375987 -0.816725 1.357277
H 2.885030 1.152505 -0.715523
H 2.732444 0.690109 1.004497
H -2.887857 1.145926 0.727733
H -2.729328 0.697116 -0.995324
H 4.753013 -0.087557 1.793375
H 5.552994 0.760707 0.422166
H 5.879682 -0.980055 0.731968
H 5.180040 -1.686516 -1.479221
H 4.776003 -0.017126 -2.019434
H 3.540668 -1.322045 -2.074800
H -5.551672 0.760915 -0.420654
H -5.876153 -0.977539 -0.745320
H -4.747091 -0.075730 -1.796300
H -3.544849 -1.339680 2.065526
H -5.181813 -1.701923 1.462026
H -4.782013 -0.036244 2.016583


