%chk=000212070.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212070

0 1
O 0.472054 2.005965 -0.828625
O 6.392007 -0.118862 -0.144148
O -6.393379 0.847477 -0.204144
O -6.240221 -1.192482 0.497752
N -0.130879 0.001866 0.026596
N 0.144759 -1.288081 0.459436
N -5.751633 -0.135829 0.127347
C -1.537191 0.200399 -0.034155
C -2.133362 -1.034593 0.394083
C -2.313387 1.312355 -0.408359
C -3.521371 -1.158778 0.451281
C 0.894546 0.965113 -0.374683
C -1.011752 -1.917244 0.684112
C 2.312421 0.605119 -0.230215
C -4.280136 -0.046224 0.079479
C -3.687465 1.175501 -0.346510
C 3.195098 1.129296 -1.207763
C 2.821411 -0.171463 0.821531
C 4.550333 0.862762 -1.147768
C 4.187371 -0.444160 0.906304
C 5.039830 0.067412 -0.082879
C 7.023966 -0.922454 0.886123
H -1.829622 2.237875 -0.736446
H -4.002266 -2.088387 0.773942
H -1.075557 -2.939788 1.031072
H -4.347072 2.007299 -0.625904
H 2.791219 1.751159 -2.013450
H 2.153536 -0.564483 1.594497
H 5.246638 1.247699 -1.891167
H 4.566340 -1.045891 1.726259
H 6.633066 -1.943771 0.863705
H 6.895264 -0.452459 1.865255
H 8.076534 -0.896448 0.571742


%chk=000212070-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212070

0 1
O 0.464633 1.770233 -1.136283
O 6.523191 0.159663 0.011471
O -6.476971 0.855433 -0.542539
O -6.373148 -1.045372 0.714209
N -0.176797 -0.065094 0.091331
N 0.072978 -1.230127 0.865666
N -5.819035 -0.070317 0.071858
C -1.563187 0.148666 -0.058450
C -2.205721 -0.923538 0.650664
C -2.312757 1.150410 -0.725964
C -3.612478 -1.014195 0.705277
C 0.862800 0.773399 -0.462723
C -1.131013 -1.725428 1.188694
C 2.307232 0.486655 -0.257025
C -4.337198 -0.011566 0.037950
C -3.712027 1.056177 -0.667860
C 3.196188 1.419518 -0.881401
C 2.874668 -0.590678 0.480400
C 4.582587 1.285636 -0.775490
C 4.271208 -0.732770 0.592729
C 5.132075 0.204202 -0.034516
C 7.155430 -0.933688 0.762169
H -1.810567 1.956547 -1.259314
H -4.137768 -1.813950 1.233109
H -1.195427 -2.631439 1.789717
H -4.346103 1.797297 -1.161394
H 2.759868 2.247726 -1.447882
H 2.214575 -1.312196 0.962064
H 5.264329 1.996665 -1.250913
H 4.674549 -1.572256 1.166731
H 6.890882 -1.917564 0.330592
H 6.867937 -0.901701 1.830159
H 8.236165 -0.760447 0.661263


