%chk=000196099.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196099

0 1
O 4.813367 -0.313672 -2.595503
O 0.313410 1.196829 2.944904
O -3.352718 -2.587945 -0.542664
N 2.365211 -0.437073 1.699668
N -2.887972 2.943900 -0.348478
C 3.666067 -0.854723 -0.424289
C 2.215555 -1.322407 -0.735016
C 1.386334 0.396260 0.907775
C 1.213071 -0.167261 -0.521995
C 3.707746 -0.323485 1.036083
C 4.134759 0.200699 -1.403374
C 1.863943 -2.451146 0.260049
C 1.949176 -1.882101 1.695064
C 5.604069 0.441049 -1.624264
C 0.060412 0.493209 1.711417
C -0.979348 1.328753 0.997091
C -2.053529 0.700857 0.270591
C -0.913268 2.700150 1.044307
C -2.980486 1.556228 -0.395643
C -2.237456 -0.705034 0.189556
C -1.897290 3.481012 0.352252
C -4.065808 0.992289 -1.145814
C -3.298476 -1.211144 -0.542092
C -4.226114 -0.366935 -1.224072
C -4.441666 -3.230108 -1.248249
H 4.339064 -1.743433 -0.513798
H 2.157830 -1.691532 -1.781513
H 1.810640 1.433419 0.851233
H 1.366399 0.629322 -1.270538
H 0.184244 -0.532769 -0.698025
H 4.442425 -0.896599 1.637151
H 4.032315 0.736134 1.078637
H 3.422104 1.001936 -1.627323
H 2.548029 -3.307482 0.134735
H 0.852242 -2.841215 0.052094
H 0.971668 -1.966547 2.213569
H 2.677978 -2.451038 2.307040
H 5.962138 1.400559 -1.989198
H 6.353865 -0.149474 -1.104360
H -0.335271 -0.515390 1.981649
H 1.123462 0.831667 3.375799
H -0.133179 3.200216 1.621524
H -1.563003 -1.383688 0.708901
H -1.845208 4.576233 0.390315
H -4.754357 1.678712 -1.646257
H -5.046496 -0.796941 -1.791711
H -5.402238 -2.941649 -0.811950
H -4.230623 -4.291917 -1.061957
H -4.389716 -3.003424 -2.316821


%chk=000196099-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196099

0 1
O 4.362726 -0.299838 -2.791457
O 0.426729 0.934272 2.988608
O -3.645350 -2.513327 -0.790779
N 2.415158 -0.311236 1.760730
N -2.832233 3.036895 -0.270548
C 3.786019 -0.741750 -0.326535
C 2.487448 -1.594719 -0.491213
C 1.310311 0.182574 0.855523
C 1.212169 -0.706193 -0.421191
C 3.723405 -0.042595 1.089741
C 3.966571 0.268473 -1.442893
C 2.429495 -2.605493 0.685464
C 2.288293 -1.786338 2.017686
C 5.313757 0.581615 -2.017536
C 0.015400 0.326321 1.722667
C -1.018934 1.215077 1.043676
C -2.112302 0.694124 0.252737
C -0.901165 2.603055 1.170485
C -2.988379 1.661346 -0.392682
C -2.390653 -0.696086 0.079169
C -1.818390 3.471002 0.502721
C -4.076361 1.191252 -1.191171
C -3.471528 -1.122213 -0.704094
C -4.323907 -0.171815 -1.355369
C -4.771562 -3.017519 -1.581398
H 4.647621 -1.437026 -0.364215
H 2.526686 -2.126200 -1.457879
H 1.604531 1.214855 0.580964
H 1.102700 -0.081959 -1.325056
H 0.323649 -1.363807 -0.389306
H 4.528979 -0.412373 1.748182
H 3.843765 1.053011 0.998933
H 3.192588 1.045997 -1.526059
H 3.344113 -3.228156 0.697652
H 1.569952 -3.288138 0.551733
H 1.315304 -1.966860 2.505948
H 3.070347 -2.060732 2.747496
H 5.501036 1.564386 -2.467685
H 6.196823 0.062584 -1.621615
H -0.412034 -0.680487 1.915388
H 1.394353 0.649981 3.075158
H -0.116352 3.013843 1.811912
H -1.787677 -1.465554 0.569288
H -1.718000 4.558374 0.603417
H -4.710487 1.947652 -1.663505
H -5.166767 -0.501475 -1.969721
H -5.740139 -2.667621 -1.174809
H -4.709972 -4.112452 -1.497290
H -4.684432 -2.721428 -2.644769


