%chk=000286928.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286928

0 1
S 0.546122 -0.890674 1.031489
O -0.294501 -0.118458 -0.233038
O 0.066330 -2.244826 1.088513
O 0.484539 -0.024813 2.169119
O 6.154838 1.436675 -0.538080
O 4.636009 2.406865 0.662690
N 5.063177 1.476720 0.003027
C -5.913357 0.691240 -0.269029
C -4.416323 0.449486 -0.234521
C -6.511610 0.560437 1.137325
C -6.591944 -0.266595 -1.256637
C -3.537121 1.477208 -0.613072
C -3.894938 -0.789197 0.172818
C -1.669885 0.035012 -0.169711
C -2.155711 1.283231 -0.581282
C -2.517687 -1.012852 0.206795
C 2.108764 -0.839849 0.294612
C 2.924246 0.280307 0.459547
C 2.542292 -1.929000 -0.473160
C 4.184828 0.295636 -0.157399
C 3.801964 -1.904324 -1.082324
C 4.629911 -0.792138 -0.930077
H -6.102554 1.738203 -0.624373
H -6.422450 -0.458986 1.528236
H -7.575731 0.819331 1.140416
H -6.004741 1.225344 1.846580
H -6.143096 -0.190764 -2.253678
H -7.659631 -0.042530 -1.353834
H -6.505775 -1.311486 -0.939343
H -3.931126 2.442078 -0.932467
H -4.572254 -1.591722 0.466225
H -1.462324 2.069695 -0.869143
H -2.119692 -1.983569 0.513310
H 2.601374 1.143619 1.065893
H 1.895002 -2.809528 -0.593712
H 4.136415 -2.755726 -1.678711
H 5.620639 -0.752746 -1.402002


%chk=000286928-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286928

0 1
S 0.647922 -0.807932 1.291736
O -0.410909 -0.583798 -0.464523
O 0.404155 -2.271458 1.965347
O 0.512441 0.552370 2.178031
O 6.097818 1.551606 -1.250313
O 4.359135 2.723221 -0.349031
N 4.940500 1.623809 -0.685914
C -5.984226 0.796830 -0.146565
C -4.503428 0.426345 -0.207040
C -6.660941 0.220609 1.127501
C -6.737508 0.340464 -1.426117
C -3.502307 1.436595 -0.181474
C -4.092196 -0.937273 -0.283049
C -1.740588 -0.256131 -0.326553
C -2.135004 1.110778 -0.228684
C -2.733189 -1.282943 -0.330879
C 2.335510 -0.825019 0.454533
C 2.961352 0.404077 0.214314
C 2.890114 -2.070555 0.114615
C 4.226803 0.346064 -0.405999
C 4.161420 -2.082919 -0.505676
C 4.836614 -0.873509 -0.773022
H -6.052322 1.901612 -0.092357
H -6.643128 -0.884918 1.123976
H -7.717847 0.540700 1.177275
H -6.149882 0.564770 2.044151
H -6.281673 0.770126 -2.335962
H -7.794485 0.661314 -1.382257
H -6.723362 -0.760614 -1.526388
H -3.806842 2.487894 -0.117664
H -4.848341 -1.730572 -0.299645
H -1.359822 1.883101 -0.200987
H -2.407347 -2.326874 -0.384016
H 2.514370 1.360411 0.501295
H 2.350391 -2.994784 0.344310
H 4.621730 -3.036611 -0.780000
H 5.819070 -0.855484 -1.251963


