%chk=000266852.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266852

0 1
S -0.481756 2.080382 -0.301229
O -0.865261 3.132887 -1.219305
O 0.079614 2.449597 0.981998
O 2.733028 -0.198600 2.066943
N 0.731507 1.166138 -1.152734
C 1.969622 1.913180 -1.499496
C 2.884665 2.208632 -0.302825
C 0.876283 -0.245500 -0.924937
C 3.629153 0.968931 0.189512
C 1.778533 -0.808259 -0.004110
C 2.694387 -0.007610 0.872503
C -1.773846 0.971318 -0.082023
C 0.043867 -1.089151 -1.692578
C 1.823668 -2.204658 0.148989
C -1.830715 0.178979 1.072432
C -2.792957 0.883958 -1.037872
C 0.111867 -2.470857 -1.535433
C 1.002948 -3.033993 -0.612609
C -2.890297 -0.705943 1.262887
C -3.855313 -0.000022 -0.853541
C -3.910485 -0.803545 0.299168
C -5.047011 -1.744983 0.513461
H 1.651546 2.868853 -1.985285
H 2.521636 1.341210 -2.279527
H 2.298919 2.653736 0.538553
H 3.617790 2.989075 -0.588256
H 4.417922 1.272509 0.912373
H 4.156265 0.466098 -0.645228
H -0.644202 -0.650727 -2.415454
H 2.507205 -2.636359 0.884616
H -1.043286 0.257852 1.833255
H -2.761429 1.519063 -1.931328
H -0.529622 -3.117151 -2.134838
H 1.050693 -4.114120 -0.488790
H -2.928584 -1.319759 2.161559
H -4.645120 -0.061227 -1.599781
H -5.653973 -1.899512 -0.388881
H -4.703011 -2.736466 0.843132
H -5.725949 -1.367256 1.294877


%chk=000266852-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266852

0 1
S -0.384849 1.670452 0.310291
O -0.632809 3.203625 -0.194689
O 0.226343 1.367116 1.796196
O 4.164095 -0.241954 1.449801
N 0.752666 0.849777 -1.149812
C 1.685274 1.924018 -1.578232
C 2.791208 2.376185 -0.604098
C 1.188372 -0.456723 -0.758557
C 3.897477 1.327876 -0.365367
C 2.383811 -0.823372 -0.045021
C 3.491489 0.091970 0.430914
C -2.001102 0.724200 0.158061
C 0.257191 -1.482681 -1.103681
C 2.582683 -2.195071 0.277566
C -2.280294 -0.263567 1.115000
C -2.887693 1.082555 -0.870153
C 0.482524 -2.832353 -0.781235
C 1.658098 -3.193105 -0.080958
C -3.519752 -0.934240 1.021170
C -4.119155 0.395563 -0.941671
C -4.452428 -0.617622 -0.002134
C -5.795258 -1.321150 -0.069261
H 1.047133 2.790833 -1.828662
H 2.128987 1.557518 -2.526588
H 2.342756 2.688939 0.357377
H 3.261322 3.278923 -1.039589
H 4.742972 1.783139 0.178939
H 4.280543 0.982588 -1.349711
H -0.636630 -1.178082 -1.656291
H 3.488585 -2.448927 0.837470
H -1.558214 -0.485188 1.907434
H -2.632674 1.879565 -1.575343
H -0.245630 -3.594427 -1.078869
H 1.851532 -4.238891 0.180169
H -3.764976 -1.711546 1.753917
H -4.832278 0.653163 -1.733107
H -6.199175 -1.330144 -1.096280
H -5.726138 -2.364836 0.283520
H -6.537702 -0.807422 0.571680


