%chk=000275066.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275066

0 1
S -2.083196 1.798914 0.368505
O -2.926909 -1.515178 -1.342732
O -3.526436 -1.258572 1.979403
O -1.676069 0.436888 -1.667220
O -0.184686 -2.041525 0.149334
O 0.526871 -2.149845 -2.004872
O 5.642361 1.612535 1.349632
O 4.290940 3.243302 0.904585
N -2.839067 2.623704 2.991044
N 4.580395 2.060101 0.951573
C -2.581570 -0.901466 0.970617
C -2.618963 -2.080415 -0.039204
C -3.102528 0.314593 0.175573
C -2.955862 -0.087118 -1.299319
C -1.329403 -2.891521 -0.146469
C -1.287696 0.184035 -3.039097
C 0.644117 -1.693438 -0.895755
C -2.556453 2.270259 1.929136
C 1.663181 -0.726423 -0.386060
C 2.904236 -1.196558 0.062278
C 1.360532 0.640746 -0.397900
C 3.863601 -0.282739 0.502447
C 2.316108 1.558820 0.041015
C 3.559245 1.086340 0.485693
H -1.574381 -0.749575 1.417658
H -3.486623 -2.755160 0.173748
H -4.170765 0.508330 0.440464
H -3.743501 0.212334 -2.013270
H -1.264368 -3.672317 0.634568
H -1.225680 -3.337812 -1.158894
H -3.376291 -0.742300 2.801833
H -1.136707 -0.897221 -3.172698
H -2.036034 0.578323 -3.730032
H -0.339691 0.725412 -3.131454
H 3.123577 -2.266195 0.067814
H 0.376800 0.982949 -0.745781
H 4.843792 -0.621457 0.858178
H 2.105125 2.634754 0.042959


%chk=000275066-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275066

0 1
S -2.878367 2.125723 0.266586
O -2.687699 -1.589269 -1.362540
O -3.927515 -1.023401 1.908647
O -1.398456 0.468556 -1.531854
O -0.258245 -1.889251 0.580469
O 0.697471 -2.670669 -1.406633
O 5.880740 2.004211 -0.415059
O 4.787483 2.816857 1.414833
N -4.614117 2.425211 2.633753
N 4.896053 2.004077 0.418865
C -2.910463 -0.714465 0.910516
C -2.686638 -2.001224 0.073138
C -3.371571 0.321505 -0.147519
C -2.714967 -0.125457 -1.461968
C -1.424559 -2.793549 0.418037
C -0.729508 0.249488 -2.831002
C 0.714550 -1.894546 -0.422960
C -3.930225 2.292995 1.656024
C 1.780583 -0.877555 -0.162250
C 2.890100 -0.845119 -1.047051
C 1.701408 0.040586 0.916026
C 3.917508 0.097504 -0.863021
C 2.722950 0.988197 1.113117
C 3.814356 1.001211 0.217429
H -1.963857 -0.377141 1.373378
H -3.561261 -2.663371 0.217280
H -4.469173 0.292557 -0.235204
H -3.295637 0.104124 -2.375789
H -1.550058 -3.287163 1.396299
H -1.206952 -3.533342 -0.371389
H -4.026939 -0.266378 2.542124
H -0.562162 -0.828198 -3.003708
H -1.333925 0.678839 -3.654599
H 0.233044 0.777308 -2.761289
H 2.927113 -1.565950 -1.869670
H 0.841490 0.005567 1.588044
H 4.784590 0.146595 -1.526336
H 2.690857 1.710440 1.932574


