%chk=000242368.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242368

0 1
O -0.490545 0.859723 -1.157213
O -0.525411 0.805276 1.167366
O -1.569259 -2.273097 -1.164496
O -1.602036 -2.323589 0.996171
N -1.763684 -1.770667 -0.074515
C -0.147305 1.599419 0.028508
C -2.343558 -0.332643 -0.049739
C 1.386102 1.639176 0.052284
C -1.852903 0.448468 -1.289616
C -1.890991 0.389450 1.239417
C 1.996991 0.231808 0.029947
C -0.811620 2.969875 0.050745
C -3.861515 -0.500485 -0.076563
C 3.528154 0.284428 0.053422
C 4.131721 -1.127253 0.031804
C 5.658187 -1.090590 0.054472
H 1.715376 2.182154 0.960344
H 1.741905 2.221863 -0.820496
H -1.812780 -0.191136 -2.199529
H -2.489713 1.330771 -1.476041
H -2.533462 1.262695 1.447591
H -1.877818 -0.291864 2.119367
H 1.613974 -0.348100 0.895206
H 1.639739 -0.308846 -0.871030
H -0.501047 3.568011 -0.815604
H -1.903527 2.914798 0.029031
H -0.533686 3.523258 0.956994
H -4.376356 0.468910 -0.060884
H -4.202219 -1.028864 -0.979810
H -4.228869 -1.071421 0.789583
H 3.902307 0.863798 -0.812185
H 3.876589 0.825756 0.953689
H 3.757835 -1.709131 0.897382
H 3.783142 -1.671274 -0.868272
H 6.061905 -0.554778 -0.811834
H 6.077287 -2.102959 0.038535
H 6.036592 -0.593041 0.954371


%chk=000242368-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242368

0 1
O -0.533485 0.863568 -1.207390
O -0.571367 0.810906 1.217791
O -1.509809 -2.254113 -1.214199
O -1.556050 -2.307448 1.057537
N -1.747721 -1.725068 -0.069671
C -0.154562 1.588508 0.027797
C -2.417146 -0.298840 -0.049115
C 1.381275 1.596942 0.052321
C -1.947769 0.494080 -1.287202
C -1.987137 0.438798 1.236820
C 2.021029 0.192525 0.028808
C -0.761484 3.004496 0.049694
C -3.938096 -0.561380 -0.078749
C 3.564365 0.254191 0.055733
C 4.220773 -1.144838 0.028154
C 5.763525 -1.087584 0.056123
H 1.696797 2.141643 0.963341
H 1.725419 2.184312 -0.821043
H -2.033344 -0.116804 -2.197949
H -2.601163 1.387946 -1.380505
H -2.643516 1.328303 1.348752
H -2.100710 -0.211341 2.116815
H 1.652028 -0.385392 0.896700
H 1.681179 -0.342185 -0.877789
H -0.410181 3.569316 -0.830416
H -1.865359 2.999463 0.033842
H -0.435798 3.530147 0.963317
H -4.484640 0.397862 -0.062670
H -4.223850 -1.108460 -0.993972
H -4.250742 -1.154159 0.798395
H 3.930136 0.844515 -0.811471
H 3.901036 0.796169 0.965242
H 3.854025 -1.734578 0.892579
H 3.884198 -1.685297 -0.879663
H 6.155085 -0.528559 -0.815140
H 6.208182 -2.099718 0.035653
H 6.124381 -0.578026 0.969934


