%chk=000125048.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000125048

0 1
O -0.645956 -2.335895 1.295893
O -2.549774 -0.138477 -0.953735
O -1.024939 -2.875357 -1.766977
O -2.812456 -2.113640 0.935818
O 3.436581 -1.515079 1.109218
O 4.425228 -0.235321 -0.434650
C -0.367294 0.248467 0.097788
C 0.248423 1.235475 -0.969936
C 0.856833 -0.476008 0.760766
C -1.354606 -0.780002 -0.516094
C -0.045198 2.677284 -0.451879
C -1.061135 1.155162 1.085837
C 1.715265 0.900682 -0.990270
C 2.037494 -0.037890 -0.079348
C -0.894167 2.455664 0.796050
C 0.693726 -1.996314 0.840452
C -1.700888 -1.806204 0.589998
C -0.858289 -1.461658 -1.817286
C -0.754213 3.528485 -1.499100
C -1.421901 3.610645 1.557464
C 3.398813 -0.547561 0.125667
H -0.211880 1.092128 -1.971165
H 0.993304 -0.082297 1.802095
H 0.907494 3.178850 -0.154045
H -1.592215 0.737520 1.925244
H 2.390855 1.391847 -1.680474
H 0.869804 -2.519458 -0.117217
H 1.328779 -2.447499 1.629547
H 0.232464 -1.343716 -1.965956
H -1.410169 -1.042592 -2.683962
H -1.722800 3.096654 -1.785469
H -0.947615 4.541963 -1.127179
H -0.154757 3.626620 -2.411724
H -0.653447 4.378927 1.725503
H -1.811044 3.320741 2.544518
H -2.249990 4.095713 1.016627
H -3.083442 0.190869 -0.189657
H -1.981577 -3.114891 -1.796334
H 4.359188 -1.862835 1.257873


%chk=000125048-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125048

0 1
O -0.563077 -2.572819 1.080238
O -2.626691 -0.095137 -0.765682
O -1.968251 -2.466732 -2.206038
O -2.791661 -2.057999 1.033268
O 3.601523 -1.319219 1.502358
O 4.600287 0.115861 -0.034141
C -0.275215 0.203032 0.091436
C 0.381477 1.180623 -0.968892
C 0.918618 -0.601499 0.767983
C -1.358616 -0.784076 -0.492253
C -0.081260 2.643884 -0.603803
C -0.892425 1.164679 1.095590
C 1.860910 0.942068 -0.813031
C 2.162002 -0.012550 0.115009
C -0.759223 2.472604 0.756586
C 0.802819 -2.137658 0.647925
C -1.640750 -1.867402 0.579722
C -1.016488 -1.415223 -1.872443
C -1.039490 3.240549 -1.667094
C -1.231206 3.661373 1.555000
C 3.553795 -0.356744 0.471391
H 0.068918 0.975382 -2.009941
H 0.925495 -0.378611 1.852035
H 0.798887 3.313970 -0.510492
H -1.373695 0.803225 2.011822
H 2.623164 1.496899 -1.371179
H 0.995189 -2.516488 -0.369771
H 1.480567 -2.639711 1.350768
H -0.025056 -1.886914 -1.913349
H -1.058377 -0.597431 -2.618910
H -1.927446 2.593024 -1.783247
H -1.380898 4.251279 -1.378843
H -0.534846 3.327044 -2.647196
H -0.397216 4.359873 1.763456
H -1.671578 3.355814 2.519253
H -1.997161 4.237781 1.001055
H -3.256616 -0.326955 -0.026826
H -2.875550 -2.068732 -2.131980
H 4.553639 -1.506060 1.724118


