%chk=000215997.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215997

1 1
S 2.701633 0.100936 -1.151460
S 0.249248 -1.833211 1.473077
N -2.310255 1.131813 0.519414
C 0.061974 0.359556 -0.269318
C -0.803674 1.146069 0.772450
C -2.614118 1.599248 -0.907576
C -0.335133 0.833057 -1.691738
C -1.840658 0.777609 -1.938456
C -2.905527 -0.235652 0.761344
C -2.956478 2.103034 1.491932
C 1.507374 0.703518 -0.032694
C -0.082229 -1.121146 -0.090811
C 2.119320 1.421102 0.954793
C -0.369375 -2.105006 -0.990405
C 3.553603 1.498244 0.800938
C -0.363427 -3.432578 -0.415647
C 4.019079 0.838141 -0.294076
C -0.061521 -3.451301 0.908989
H -0.602450 0.761279 1.799589
H -0.462348 2.210746 0.760888
H -2.342094 2.677908 -1.000391
H -3.710611 1.530986 -1.094333
H 0.190193 0.221356 -2.458418
H 0.044605 1.864406 -1.856656
H -2.067796 1.172083 -2.955804
H -2.196938 -0.273988 -1.957078
H -2.620890 -0.638925 1.752378
H -4.008148 -0.219475 0.708001
H -2.549912 -0.973916 0.011722
H -2.562126 3.129589 1.376120
H -4.052403 2.156334 1.349339
H -2.784537 1.802778 2.543463
H 1.634651 1.898480 1.794068
H -0.569173 -1.959795 -2.044923
H 4.172282 2.037520 1.509808
H -0.574741 -4.310775 -1.017392
H 5.038101 0.738863 -0.637669
H 0.016503 -4.299289 1.573235


%chk=000215997-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215997

1 1
S 2.806536 -0.114642 -1.014571
S 0.175385 -1.957784 1.518369
N -2.311910 1.131536 0.548892
C 0.062791 0.321736 -0.265630
C -0.780252 1.126272 0.772291
C -2.623533 1.588742 -0.895949
C -0.346616 0.800925 -1.700601
C -1.870456 0.761347 -1.943720
C -2.955753 -0.226195 0.835431
C -2.915171 2.147020 1.519826
C 1.530760 0.690125 -0.009882
C -0.105961 -1.191887 -0.107510
C 2.106350 1.586694 0.883158
C -0.352815 -2.170079 -1.062161
C 3.545498 1.663145 0.790762
C -0.353325 -3.518358 -0.543118
C 4.077661 0.828567 -0.174288
C -0.101795 -3.585539 0.814670
H -0.612976 0.757938 1.799028
H -0.484372 2.188398 0.717675
H -2.321071 2.650223 -0.950873
H -3.718368 1.525877 -1.018630
H 0.182542 0.199132 -2.458012
H 0.021877 1.837576 -1.822189
H -2.097934 1.205370 -2.930267
H -2.248825 -0.274848 -1.975876
H -2.713369 -0.522345 1.867137
H -4.045518 -0.121096 0.714935
H -2.560519 -0.982536 0.146579
H -2.474264 3.138005 1.332961
H -4.004133 2.188565 1.363052
H -2.700265 1.830496 2.552106
H 1.548742 2.180952 1.611956
H -0.509169 -1.955693 -2.122603
H 4.157163 2.312482 1.420598
H -0.527108 -4.402336 -1.160473
H 5.117089 0.678535 -0.460407
H -0.034912 -4.456721 1.464038


