%chk=000207599.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207599

0 1
O 4.232405 1.295176 -1.053319
N 3.852444 -0.653068 0.068816
C 6.194751 -0.074599 -0.683945
C -2.704949 -0.042490 0.055404
C -4.160008 0.199039 0.231477
C 2.451142 -0.384950 0.282875
C 4.700750 0.271396 -0.589755
C -4.832067 -0.357088 -0.908836
C -0.294011 0.072910 0.674240
C -1.725909 0.313953 0.898880
C -2.585542 -0.770051 -1.239980
C 6.897091 0.520143 0.537585
C 6.747647 0.490242 -1.992026
C -3.807778 -0.949876 -1.792606
C 1.827547 -0.804881 1.474198
C 1.698600 0.282819 -0.702955
C 0.465179 -0.574406 1.662340
C 0.338616 0.506974 -0.503235
C -4.876586 0.824552 1.235138
C 4.382735 -1.904763 0.663840
C -6.208326 -0.279751 -1.026982
C -6.278985 0.899265 1.108088
C -6.930227 0.359030 0.001398
H 6.339430 -1.186816 -0.688726
H -1.961208 0.822578 1.839377
H -1.631430 -1.090873 -1.621442
H 6.781232 1.613084 0.572145
H 7.973184 0.312228 0.514468
H 6.499318 0.119094 1.476216
H 6.522970 1.564400 -2.086699
H 6.303363 -0.001674 -2.865031
H 7.834127 0.371149 -2.053006
H -4.053175 -1.438259 -2.718418
H 2.396945 -1.293737 2.260649
H 2.184816 0.646988 -1.612485
H -0.012836 -0.903620 2.584490
H -0.239007 1.033220 -1.264591
H -4.382208 1.252005 2.103355
H 5.252306 -2.274184 0.087708
H 3.617312 -2.700640 0.641045
H 4.699623 -1.751070 1.709132
H -6.726343 -0.697039 -1.886114
H -6.855924 1.388918 1.890732
H -8.014110 0.428471 -0.076644


%chk=000207599-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207599

0 1
O 4.265765 0.979540 -1.458775
N 3.965977 -0.618344 0.230393
C 6.293318 -0.143837 -0.699733
C -2.813364 -0.099585 -0.206040
C -4.246596 0.094275 0.156781
C 2.537961 -0.431471 0.312440
C 4.768274 0.111130 -0.684755
C -5.022753 -0.005223 -1.047211
C -0.330968 -0.192052 0.520565
C -1.778707 -0.087316 0.710946
C -2.799677 -0.326042 -1.666403
C 6.970837 0.677908 0.434630
C 6.872520 0.247854 -2.077410
C -4.093014 -0.276402 -2.155727
C 1.871281 -0.654472 1.550007
C 1.749635 -0.062525 -0.816419
C 0.475712 -0.526030 1.647584
C 0.354605 0.049805 -0.708640
C -4.877891 0.349419 1.387863
C 4.559257 -1.523892 1.242251
C -6.423858 0.145440 -1.016085
C -6.289203 0.497393 1.418238
C -7.053724 0.396866 0.229344
H 6.507252 -1.217699 -0.537977
H -2.081113 -0.002111 1.766466
H -1.913627 -0.555947 -2.257008
H 6.770608 1.754378 0.288222
H 8.064897 0.525353 0.409906
H 6.609012 0.396520 1.439839
H 6.645017 1.302243 -2.304948
H 6.439105 -0.366943 -2.885816
H 7.968733 0.106180 -2.077974
H -4.392219 -0.429778 -3.195372
H 2.437648 -0.909019 2.450123
H 2.237060 0.158505 -1.765170
H -0.007517 -0.697195 2.617397
H -0.206090 0.374520 -1.588550
H -4.302658 0.436712 2.317318
H 5.545461 -1.876393 0.915837
H 3.908561 -2.404381 1.374549
H 4.682199 -1.025412 2.223073
H -7.018638 0.072117 -1.933636
H -6.794093 0.692832 2.370961
H -8.142080 0.516879 0.275718


