%chk=000281013.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281013

0 1
O -3.510270 0.552241 -0.382254
O 2.147888 1.151525 0.011999
O -2.745532 0.083894 1.699316
O 3.912331 -0.266654 -0.082248
O 1.619877 -3.626028 -0.467224
N 0.818510 -1.532912 -0.055264
C -0.199883 -0.667927 0.574891
C -1.475419 -0.588531 -0.282220
C 1.734292 -0.919882 -1.032837
C -2.600892 0.026889 0.500798
C 2.756259 -0.037632 -0.323210
C 0.848567 -2.923633 0.158188
C -4.727396 1.163751 0.158330
C 2.950227 2.175025 0.686090
C -5.700685 0.085613 0.583301
C 3.845279 2.870363 -0.317023
H -0.445758 -1.053163 1.593430
H 0.223054 0.358615 0.725152
H -1.292821 -0.013869 -1.216851
H -1.789994 -1.596486 -0.632366
H 2.289652 -1.732188 -1.581569
H 1.177496 -0.321765 -1.789522
H 0.140656 -3.287725 0.917379
H -5.070357 1.743648 -0.718317
H -4.442224 1.833389 0.989088
H 2.156266 2.828268 1.091297
H 3.518545 1.691492 1.500628
H -5.862229 -0.651905 -0.213428
H -5.331717 -0.460998 1.464444
H -6.677454 0.509133 0.847464
H 4.627835 2.191666 -0.690149
H 3.280312 3.224809 -1.188369
H 4.349987 3.736176 0.128556


%chk=000281013-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281013

0 1
O -3.769125 0.574456 0.080528
O 2.675722 1.596402 -1.067481
O -3.093916 -0.772980 1.864965
O 2.297980 0.750962 1.079685
O 2.178868 -3.129687 -0.590501
N 0.718967 -1.363823 -0.064741
C -0.427390 -0.897917 0.735801
C -1.658073 -0.544229 -0.133562
C 1.436750 -0.432242 -0.934349
C -2.883608 -0.284471 0.729954
C 2.167272 0.670088 -0.161182
C 1.191516 -2.666106 0.044720
C -5.061592 0.864163 0.783738
C 3.492187 2.717739 -0.497605
C -6.099849 -0.217264 0.474806
C 4.950820 2.287483 -0.326252
H -0.709236 -1.696795 1.443823
H -0.123363 -0.026551 1.343923
H -1.483838 0.335265 -0.776509
H -1.892514 -1.393965 -0.805135
H 2.189614 -1.024169 -1.490616
H 0.770353 0.037675 -1.680347
H 0.593021 -3.271590 0.760530
H -5.354490 1.848264 0.384982
H -4.860772 0.933406 1.867170
H 3.378585 3.521261 -1.242351
H 3.043841 3.020266 0.465074
H -6.247227 -0.323645 -0.613740
H -5.790697 -1.189990 0.892655
H -7.069678 0.058658 0.928719
H 5.038799 1.485901 0.426005
H 5.371655 1.929847 -1.281550
H 5.553823 3.148785 0.016344


