%chk=000228034.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228034

0 1
O 4.418963 -1.911014 -0.303340
O 1.822803 -2.405948 0.181792
O 3.684600 1.448416 0.821307
O 1.002076 -0.671113 1.995482
O 5.176617 1.851569 -1.689028
O -0.205142 -0.033584 -1.259188
O -6.589032 0.970563 -0.502724
N -1.221008 0.208743 0.806400
C 3.629541 -0.933716 0.383242
C 2.171448 -1.035884 -0.116602
C 4.329792 0.407475 0.063302
C 1.214013 -0.139278 0.692845
C 4.200858 0.849206 -1.403708
C -0.138679 0.009086 -0.041298
C -2.584580 0.399581 0.399925
C -3.555891 0.501073 1.422373
C -2.958345 0.491387 -0.951559
C -4.891853 0.692984 1.094552
C -4.298591 0.683439 -1.289427
C -5.247405 0.781822 -0.263942
H 3.665910 -1.148121 1.478096
H 2.079877 -0.854671 -1.212068
H 5.406745 0.343336 0.348790
H 1.660040 0.879952 0.874156
H 4.470975 0.018784 -2.089665
H 3.191064 1.236111 -1.630922
H 3.987932 -2.799621 -0.216952
H 1.138680 -2.722593 -0.452347
H 4.000837 1.450787 1.748701
H -1.045594 0.190029 1.820981
H 1.010172 -1.671000 1.952950
H 4.978080 2.664206 -1.170320
H -3.266378 0.430971 2.470607
H -2.202607 0.412903 -1.743288
H -5.662997 0.775805 1.858787
H -4.590794 0.755149 -2.333495
H -6.787725 1.031167 -1.468913


%chk=000228034-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228034

0 1
O 4.402813 -2.014939 -0.231873
O 1.721587 -2.386234 0.133225
O 3.853942 1.505986 0.861253
O 1.017274 -0.453935 1.965839
O 5.297515 1.965828 -1.527534
O -0.192011 -0.030651 -1.463345
O -6.742972 0.923237 -0.350781
N -1.221156 0.205854 0.653089
C 3.617313 -0.942162 0.387374
C 2.174816 -0.989181 -0.152130
C 4.405427 0.356221 0.102005
C 1.205159 -0.032169 0.565599
C 4.405460 0.818286 -1.359776
C -0.146664 0.039957 -0.192208
C -2.597435 0.377698 0.330015
C -3.519241 0.500023 1.405190
C -3.072415 0.437841 -1.005971
C -4.891129 0.680307 1.158996
C -4.449517 0.619316 -1.250613
C -5.359616 0.740823 -0.174133
H 3.571737 -1.091461 1.490661
H 2.141564 -0.806581 -1.239988
H 5.454780 0.170071 0.407781
H 1.655118 0.975801 0.611510
H 4.803808 0.017882 -2.001420
H 3.374154 1.075431 -1.682700
H 3.845891 -2.836274 -0.170614
H 1.039515 -2.644995 -0.536631
H 4.045601 1.396865 1.825879
H -0.957971 0.179736 1.648219
H 1.010249 -1.453000 1.941021
H 5.015074 2.646504 -0.862180
H -3.160656 0.457726 2.441125
H -2.364396 0.343702 -1.831585
H -5.607649 0.777058 1.979402
H -4.807751 0.666656 -2.287257
H -6.973814 0.960775 -1.311942


