%chk=000179496.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179496

0 1
O -1.622495 -3.108327 0.950803
O -3.050167 -2.387206 -0.605462
O 3.701931 1.553574 1.072564
O 3.667990 1.821662 -1.152765
N 0.513119 1.304333 -0.037835
C 0.256796 -1.140241 -0.033287
C -1.144142 -0.988442 0.009651
C -1.724320 0.294069 0.015544
C 1.055902 0.058397 -0.065966
C -0.835835 1.433797 0.003304
C 2.500009 -0.063232 -0.126115
C 0.935853 -2.412834 -0.051382
C -3.145801 0.545277 0.032070
C -1.390995 2.773332 0.031012
C 3.096860 -1.290318 -0.140594
C 2.296128 -2.482550 -0.103463
C -2.046171 -2.173107 0.032186
C -3.628702 1.818499 0.054119
C -2.738696 2.951126 0.058502
C 3.310818 1.184887 -0.193668
H 0.330001 -3.323482 -0.006802
H -3.826092 -0.311585 0.006011
H -0.686380 3.608811 0.025506
H 4.183780 -1.394340 -0.179554
H 2.810624 -3.444826 -0.115201
H -4.702566 2.011445 0.063946
H -3.177081 3.949781 0.079688
H -2.240748 -3.890478 1.004648
H 4.213179 2.408380 1.078240


%chk=000179496-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179496

0 1
O -1.608112 -3.245306 0.925822
O -3.180059 -2.314151 -0.485474
O 3.126440 2.022935 0.980835
O 4.462707 1.256982 -0.749120
N 0.531893 1.301027 -0.036714
C 0.267631 -1.170243 -0.002277
C -1.157926 -1.024541 0.059197
C -1.740817 0.285512 0.052903
C 1.078314 0.051002 -0.020542
C -0.827873 1.427543 0.000296
C 2.522639 -0.061527 -0.088497
C 0.943214 -2.437580 -0.115458
C -3.155747 0.556847 0.107759
C -1.357345 2.765833 -0.009151
C 3.120558 -1.313278 -0.236921
C 2.325928 -2.502041 -0.249416
C -2.074758 -2.208721 0.098535
C -3.629064 1.865859 0.105129
C -2.728135 2.983803 0.043240
C 3.441045 1.118879 -0.032048
H 0.356988 -3.357478 -0.095382
H -3.862202 -0.275271 0.125162
H -0.632543 3.583849 -0.050336
H 4.209259 -1.374836 -0.333110
H 2.818157 -3.474213 -0.354498
H -4.708483 2.048363 0.145005
H -3.128422 4.003162 0.040117
H -2.288821 -3.973624 0.924832
H 3.788335 2.767615 0.955811


