%chk=000257839.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257839

0 1
O -6.009851 2.192280 -1.281907
O -7.027049 0.732071 -0.054148
O 5.555252 1.634591 1.451235
N 5.083476 0.949885 -0.700957
N -6.017867 1.231653 -0.527471
C -0.548152 -2.193493 -0.138353
C 0.826195 -2.805684 0.172135
C -0.942232 -1.114431 0.883189
C 1.945447 -1.823189 -0.037973
C -2.264170 -0.500726 0.522284
C 2.394299 -1.529016 -1.335056
C 2.551011 -1.185622 1.055121
C -2.313955 0.609019 -0.340962
C -3.458504 -1.037232 1.036256
C 4.026982 0.020523 -0.434330
C 3.426341 -0.615722 -1.541591
C 3.584669 -0.268883 0.867990
C -3.535965 1.179369 -0.686392
C -4.686791 -0.475292 0.697862
C -4.720718 0.633124 -0.164545
C 5.790741 1.705358 0.262549
C 6.849749 2.594806 -0.328417
H -1.314116 -2.993752 -0.151404
H -0.543412 -1.758310 -1.157969
H 0.840276 -3.197971 1.209477
H 0.983173 -3.696867 -0.471736
H -0.973221 -1.549882 1.902792
H -0.147224 -0.337481 0.928085
H 1.933642 -2.018402 -2.192547
H 2.216305 -1.406474 2.068714
H -1.389206 1.025626 -0.742115
H -3.424532 -1.898531 1.703372
H 3.759717 -0.403101 -2.554129
H 4.047803 0.220437 1.732645
H -3.586774 2.044630 -1.356376
H -5.623281 -0.883859 1.093102
H 5.332559 1.060382 -1.685250
H 7.627200 2.030597 -0.859994
H 7.357513 3.152181 0.478167
H 6.437471 3.342986 -1.017952


%chk=000257839-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257839

0 1
O -6.155917 2.148730 -1.407438
O -7.189612 0.674615 -0.007520
O 5.805504 1.582276 1.542949
N 5.143174 0.983315 -0.629613
N -6.131983 1.177585 -0.554637
C -0.570169 -2.208843 -0.143023
C 0.827433 -2.825581 0.152724
C -0.964596 -1.090052 0.863754
C 1.973997 -1.839913 -0.025264
C -2.310365 -0.476350 0.525639
C 2.401182 -1.454520 -1.323339
C 2.636533 -1.256734 1.083517
C -2.402558 0.593748 -0.406147
C -3.509652 -0.984997 1.094120
C 4.093970 0.052394 -0.377401
C 3.442769 -0.525139 -1.501782
C 3.682851 -0.321875 0.929106
C -3.646881 1.142897 -0.767234
C -4.765926 -0.452048 0.748439
C -4.817467 0.608473 -0.183392
C 5.929661 1.687181 0.288195
C 6.969638 2.597993 -0.366724
H -1.335947 -3.009149 -0.117602
H -0.579288 -1.793114 -1.169792
H 0.831488 -3.225246 1.185374
H 0.968828 -3.691442 -0.523658
H -0.985430 -1.522092 1.883125
H -0.176080 -0.314565 0.854886
H 1.919022 -1.894523 -2.205130
H 2.334219 -1.542760 2.098650
H -1.484854 1.001855 -0.845206
H -3.454272 -1.804872 1.819483
H 3.758457 -0.250367 -2.517189
H 4.184660 0.117326 1.792844
H -3.731818 1.968735 -1.478462
H -5.695701 -0.831293 1.180632
H 5.345288 1.154588 -1.617855
H 7.676162 2.019985 -0.991039
H 7.535735 3.107131 0.426149
H 6.490746 3.362244 -1.006740


