%chk=000194982.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194982

0 1
O 0.064711 -0.749180 -2.171300
O 0.130684 0.390561 2.467982
O -1.103301 -3.764068 1.088704
N -0.530196 -2.247459 -0.574311
N -0.498860 -1.652490 1.755552
C -0.154807 0.184355 0.055503
C 1.135780 1.013074 -0.191091
C 2.420575 0.196817 -0.012685
C -1.377924 1.087838 -0.108979
C -0.175888 -0.933950 -0.999185
C -0.140095 -0.300387 1.512048
C 3.658049 1.070040 -0.263716
C 4.954128 0.265993 -0.088129
C -1.594079 2.112675 0.828685
C -2.272192 0.938180 -1.177305
C -0.749922 -2.649352 0.772453
C -0.637489 -3.318553 -1.606730
C 6.188733 1.129206 -0.336683
C -2.694287 2.962194 0.704834
C -3.373931 1.792257 -1.296719
C -3.590141 2.803351 -0.357797
H 1.142006 1.882999 0.499042
H 1.089181 1.433457 -1.219348
H 2.469048 -0.227522 1.009813
H 2.430385 -0.664974 -0.709427
H 3.619071 1.498116 -1.284512
H 3.658666 1.935386 0.427412
H 4.997455 -0.161941 0.932809
H 4.958271 -0.599067 -0.780167
H -0.580244 -1.954159 2.741638
H -0.903783 2.247438 1.667888
H -2.123250 0.173518 -1.941403
H -0.866236 -2.873637 -2.592663
H -1.439107 -4.030242 -1.337606
H 0.312953 -3.872874 -1.686934
H 6.197946 1.539185 -1.353158
H 7.109465 0.548398 -0.209922
H 6.237563 1.975362 0.358296
H -2.853537 3.750930 1.439799
H -4.063469 1.665867 -2.131135
H -4.449234 3.465559 -0.452955


%chk=000194982-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194982

0 1
O 0.279817 -0.961076 -2.085879
O 0.379730 0.263995 2.537428
O -1.637933 -3.672825 1.185299
N -0.755334 -2.281092 -0.496014
N -0.678335 -1.647224 1.797821
C -0.061066 0.084005 0.111731
C 1.209949 0.951668 -0.159423
C 2.553164 0.211800 0.021325
C -1.333946 0.981231 -0.087338
C -0.127312 -1.079446 -0.899594
C -0.066290 -0.405646 1.569665
C 3.757635 1.128633 -0.291118
C 5.119121 0.418394 -0.115266
C -1.740252 1.864763 0.946818
C -2.037957 0.998032 -1.318640
C -1.078844 -2.600257 0.843216
C -1.005021 -3.308090 -1.536696
C 6.319878 1.332210 -0.441363
C -2.838398 2.731488 0.757477
C -3.136821 1.867099 -1.502479
C -3.545532 2.734774 -0.466006
H 1.166918 1.818228 0.525226
H 1.128453 1.332700 -1.193418
H 2.641882 -0.157698 1.062401
H 2.591063 -0.668966 -0.650492
H 3.672951 1.503947 -1.332138
H 3.722959 2.020942 0.368249
H 5.205137 0.048999 0.926973
H 5.147777 -0.478634 -0.767159
H -0.812418 -1.928559 2.774621
H -1.196486 1.884115 1.897078
H -1.723266 0.355269 -2.146453
H -1.601885 -2.869454 -2.351911
H -1.546789 -4.140389 -1.066266
H -0.048995 -3.661556 -1.956018
H 6.271685 1.691521 -1.486715
H 7.280595 0.801023 -0.310700
H 6.332932 2.220859 0.217762
H -3.138236 3.405424 1.567595
H -3.668863 1.866530 -2.460318
H -4.398967 3.406163 -0.610682


