%chk=000235289.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235289

0 1
O -2.232914 0.880869 -1.810043
O -3.315806 -2.522507 1.118921
O 3.061964 -1.275598 -0.736543
O 2.714942 0.743184 -1.772845
N 0.105518 1.559940 0.113262
N -1.498694 -1.231738 1.688188
N 0.423132 0.340419 2.029515
N -2.773978 -0.816097 -0.350429
N 3.571761 0.610013 0.402435
C -0.894483 0.572545 0.147893
C 0.882744 1.389324 1.250719
C -0.670826 -0.163802 1.346913
C 2.057041 2.213706 1.639028
C -1.968808 0.298442 -0.776114
C -2.589302 -1.588133 0.836613
C 3.275697 2.027647 0.714501
C 0.300937 2.494623 -0.995545
C -1.265759 -1.985105 2.944102
C -3.939712 -1.198897 -1.195060
C 3.049773 0.097670 -0.796030
C 2.576841 -1.990023 -1.924994
C 1.066341 -1.927021 -1.974050
H 2.335892 1.950895 2.689650
H 1.779082 3.289895 1.676781
H 3.134139 2.591464 -0.239872
H 4.182013 2.455233 1.205748
H 1.169373 2.178559 -1.623288
H -0.590798 2.500229 -1.662856
H 0.470167 3.520180 -0.632167
H -0.246829 -2.411853 2.947952
H -2.001026 -2.807396 3.037070
H -1.365313 -1.314868 3.816402
H -3.811493 -0.794991 -2.216856
H -4.872868 -0.791688 -0.770101
H -4.032416 -2.298296 -1.249003
H 3.615728 -0.024878 1.205331
H 3.056212 -1.551851 -2.818143
H 2.970505 -3.002267 -1.716785
H 0.661238 -2.586397 -2.751211
H 0.616737 -2.223406 -1.016959
H 0.714147 -0.906927 -2.194430


%chk=000235289-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235289

0 1
O -2.529594 1.226726 -1.705697
O -3.492455 -2.440581 1.098227
O 3.438942 -1.338312 -0.807822
O 2.559802 0.626536 -1.777512
N -0.049052 1.696548 0.153818
N -1.602256 -1.154041 1.627804
N 0.331588 0.351749 1.963883
N -2.975311 -0.618517 -0.284702
N 3.502275 0.601638 0.374845
C -1.063246 0.724367 0.163974
C 0.768642 1.433273 1.246239
C -0.796057 -0.077966 1.285477
C 1.992860 2.215484 1.618790
C -2.198611 0.523444 -0.699110
C -2.730707 -1.465831 0.834753
C 3.214025 2.006896 0.666149
C 0.151887 2.708718 -0.901242
C -1.289059 -1.976899 2.810915
C -4.171937 -0.962744 -1.086621
C 3.111501 0.024117 -0.814567
C 3.004796 -2.110753 -2.008920
C 1.547279 -2.560151 -1.874872
H 2.260446 1.896796 2.641052
H 1.776764 3.301547 1.658875
H 3.036342 2.502379 -0.302478
H 4.101183 2.478510 1.128059
H 0.944643 2.366408 -1.589305
H -0.791245 2.817457 -1.457563
H 0.431858 3.674365 -0.446924
H -0.280264 -2.411690 2.712129
H -2.044418 -2.773905 2.870248
H -1.316677 -1.356769 3.722705
H -4.232612 -0.237206 -1.910837
H -5.076903 -0.911153 -0.459340
H -4.081709 -1.989251 -1.477642
H 3.876443 -0.014035 1.097900
H 3.149538 -1.479338 -2.903030
H 3.701925 -2.963796 -2.029752
H 1.274072 -3.201027 -2.733815
H 1.396982 -3.142002 -0.948981
H 0.869218 -1.689895 -1.867409


