%chk=000297248.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297248

0 1
S 2.846320 -0.920327 0.131229
O 3.601324 -2.359547 -0.362518
O 3.277242 -0.691075 1.480224
O 3.268896 -0.003385 -0.907544
N -3.468143 -1.202632 0.071632
N -3.378900 0.168208 0.128209
C -1.270137 -0.814479 0.003018
C 0.156355 -0.465528 -0.022159
C 0.180254 1.041003 -0.069666
C -2.063297 0.423844 0.084023
C -1.159212 1.565175 0.048681
C -2.208632 -1.840014 -0.009318
C 1.186255 -1.330094 0.059086
C 1.218018 1.943863 -0.215165
C -1.431327 2.916938 0.076538
C -2.131380 -3.308041 -0.104550
C 0.971334 -2.807278 0.152117
C 0.945750 3.331375 -0.187898
C -0.346666 3.813178 -0.035012
H 2.258765 1.638449 -0.383346
H -2.452070 3.283299 0.175204
H -4.377524 -1.641800 0.088605
H -3.090010 -3.815964 0.073461
H -1.780115 -3.621582 -1.103446
H -1.412616 -3.715026 0.633097
H 1.863531 -3.379577 0.460324
H 0.188994 -3.051191 0.890323
H 0.667186 -3.215558 -0.824401
H 1.780125 4.026245 -0.293552
H -0.536286 4.886095 -0.009078
H 4.400667 -2.233276 -0.897219


%chk=000297248-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297248

0 1
S 2.930453 -0.826421 -0.301984
O 3.616847 -2.550112 -0.580743
O 3.665243 -0.208160 1.005806
O 3.079105 -0.024155 -1.700172
N -3.502326 -1.176587 -0.040510
N -3.414208 0.220962 -0.029378
C -1.315597 -0.815462 0.045097
C 0.131204 -0.472220 0.016384
C 0.172357 1.043013 -0.005111
C -2.072014 0.409203 0.017898
C -1.172550 1.557238 0.000268
C -2.279958 -1.847916 -0.011037
C 1.136624 -1.404570 0.037722
C 1.245872 1.958734 0.044368
C -1.444973 2.934588 0.012377
C -2.271190 -3.352035 -0.065085
C 1.060332 -2.876895 0.322857
C 0.971215 3.349315 0.053983
C -0.355554 3.837460 0.029626
H 2.289832 1.646633 0.089815
H -2.478342 3.293994 0.016020
H -4.426742 -1.602622 -0.077084
H -3.262578 -3.735111 -0.366915
H -1.537375 -3.723020 -0.798704
H -2.030591 -3.804279 0.914631
H 1.859692 -3.190352 1.015332
H 0.094350 -3.091287 0.802233
H 1.176798 -3.491625 -0.586968
H 1.808996 4.053670 0.084627
H -0.539437 4.917224 0.036013
H 4.569216 -2.407904 -0.850466


