%chk=000187662.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187662

0 1
O -0.681863 -0.838161 1.887699
O 5.137966 0.713627 0.621014
N 3.327240 0.010205 -0.366911
N 4.556273 -0.199527 0.093477
C 0.433647 -0.114285 -0.098848
C 1.284185 -1.406179 -0.183392
C 1.245716 1.038317 0.546344
C 2.592230 -1.138139 -0.962576
C 2.551836 1.276579 -0.240852
C 0.511366 -2.537357 -0.862434
C 0.433303 2.332834 0.595084
C -0.798324 -0.386501 0.766472
C -2.150663 -0.078268 0.205240
C -2.339076 0.414155 -1.093931
C -3.267775 -0.297720 1.029032
C -3.625559 0.684989 -1.564584
C -4.554529 -0.026532 0.558256
C -4.733932 0.465023 -0.738631
H 0.133092 0.188718 -1.131166
H 1.543443 -1.719960 0.862650
H 1.508459 0.734555 1.594034
H 3.237728 -2.046566 -0.951995
H 2.379264 -0.908125 -2.030213
H 2.342144 1.676320 -1.255391
H 3.181863 2.036737 0.279300
H 0.180736 -2.273756 -1.872572
H 1.118576 -3.447699 -0.940942
H -0.383179 -2.810224 -0.286072
H 1.014612 3.151680 1.037783
H 0.108139 2.661848 -0.397562
H -0.467447 2.220155 1.212693
H -1.475195 0.586457 -1.741282
H -3.114730 -0.683542 2.042270
H -3.766970 1.067251 -2.574144
H -5.416410 -0.198424 1.201761
H -5.737566 0.677015 -1.107110


%chk=000187662-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187662

0 1
O -0.681822 -0.636974 1.952157
O 5.257233 0.686045 0.561083
N 3.333734 -0.040329 -0.366558
N 4.631067 -0.311929 0.040922
C 0.450180 -0.034656 -0.089925
C 1.241785 -1.382166 -0.184270
C 1.319870 1.084197 0.577425
C 2.576122 -1.158979 -0.936882
C 2.656951 1.254283 -0.185110
C 0.431449 -2.492386 -0.887410
C 0.585160 2.440572 0.638396
C -0.819822 -0.257581 0.747958
C -2.194760 -0.048011 0.177469
C -2.435263 0.416935 -1.144545
C -3.308860 -0.335770 1.016942
C -3.755788 0.588712 -1.613934
C -4.624749 -0.166905 0.547989
C -4.852801 0.296556 -0.771347
H 0.199841 0.289592 -1.119360
H 1.467445 -1.697753 0.853325
H 1.543245 0.746214 1.608360
H 3.220487 -2.053033 -0.878754
H 2.360968 -0.954335 -2.007786
H 2.469194 1.710270 -1.179974
H 3.356587 1.907357 0.367143
H 0.146628 -2.192236 -1.914602
H 1.021190 -3.424877 -0.958843
H -0.494261 -2.727186 -0.333589
H 1.228584 3.215011 1.094459
H 0.301462 2.788832 -0.373773
H -0.334818 2.372772 1.245528
H -1.601449 0.650259 -1.813599
H -3.106433 -0.691240 2.032711
H -3.929871 0.949137 -2.633571
H -5.473106 -0.393756 1.202711
H -5.876783 0.428859 -1.138245


