%chk=000184891.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184891

0 1
O -0.947559 1.785867 -0.242859
O -4.133390 -1.886866 0.487118
O -1.492942 -2.298331 -0.302504
O 1.143718 -2.523500 -0.209187
O 3.691384 1.559782 0.126931
O 3.725315 -2.538488 -0.058209
N -4.846943 0.305649 0.232653
C -2.438231 -0.147093 0.112986
C -2.236034 1.170566 -0.628324
C -3.842727 -0.700085 -0.247627
C -3.298760 2.194271 -0.241808
C -4.696262 1.602751 -0.505034
C -1.291931 -1.110608 -0.166486
C 0.018047 -0.453497 -0.182104
C 0.124760 0.962202 -0.155901
C -6.236135 -0.221784 0.145764
C 1.223475 -1.202740 -0.152771
C 1.352861 1.639327 -0.039984
C 2.488162 -0.545982 -0.049509
C 2.501113 0.858182 0.015101
C 3.731159 -1.306936 -0.003419
C 4.894852 0.842449 0.172489
C 4.944776 -0.501052 0.112003
C 5.997278 1.819783 0.291814
H -2.441811 0.034179 1.228184
H -2.158921 1.028828 -1.729873
H -3.912042 -0.947070 -1.335080
H -3.162129 3.138459 -0.801052
H -3.195102 2.461176 0.832435
H -5.467605 2.302992 -0.111943
H -4.875291 1.509536 -1.597955
H -6.616119 -0.365879 -0.875146
H -6.909761 0.458289 0.690132
H -6.269187 -1.200221 0.668069
H -3.392027 -2.546842 0.368146
H 1.389445 2.725216 -0.003095
H 2.102208 -2.995764 -0.169520
H 5.886494 -1.051628 0.147720
H 6.983953 1.331734 0.332657
H 5.895197 2.438007 1.201605
H 6.010214 2.524023 -0.559017


%chk=000184891-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000184891

0 1
O -0.978021 1.853664 -0.074262
O -4.138767 -1.894831 0.633870
O -1.534878 -2.308564 -0.148970
O 1.208775 -2.539058 -0.242680
O 3.756177 1.576782 0.134443
O 3.729515 -2.586732 -0.153935
N -4.933426 0.285733 0.173272
C -2.490855 -0.091420 0.241538
C -2.273473 1.234230 -0.493562
C -3.873662 -0.692849 -0.135983
C -3.395580 2.223371 -0.195107
C -4.743079 1.559425 -0.558229
C -1.328695 -1.057702 -0.044839
C 0.006182 -0.426398 -0.122340
C 0.124646 1.011285 -0.054183
C -6.293520 -0.270250 -0.005188
C 1.222689 -1.185136 -0.152396
C 1.366710 1.674724 0.039096
C 2.499801 -0.520311 -0.062348
C 2.527490 0.894886 0.041698
C 3.741636 -1.287163 -0.067139
C 4.959148 0.851635 0.127154
C 4.974848 -0.519769 0.030759
C 6.141985 1.764655 0.236028
H -2.524423 0.104028 1.333122
H -2.195138 1.053522 -1.588130
H -3.862322 -0.951354 -1.235747
H -3.256821 3.151669 -0.777972
H -3.384836 2.476321 0.879815
H -5.570056 2.237480 -0.283038
H -4.797684 1.414072 -1.670964
H -6.540819 -0.482912 -1.075049
H -7.031962 0.451266 0.386776
H -6.369136 -1.208196 0.562992
H -3.375640 -2.511504 0.431063
H 1.407928 2.763551 0.088558
H 2.214014 -2.865857 -0.223538
H 5.924686 -1.057756 0.028718
H 7.079093 1.187600 0.227266
H 6.093931 2.353361 1.170041
H 6.157040 2.483401 -0.603209


