%chk=000212904.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212904

0 1
O 0.450106 0.763476 0.026743
O 2.438923 2.781130 -2.000675
O -0.911192 1.783936 1.556582
N -1.693714 0.030933 0.228608
C 2.792008 1.049430 -0.267113
C 2.965216 -0.482182 -0.145593
C 1.580247 1.526667 0.563734
C 2.539189 1.369963 -1.768709
C 4.028970 1.819100 0.208829
C 3.371011 -0.970968 1.250102
C -3.065544 0.056500 0.803307
C -1.338899 -1.014615 -0.766926
C 3.570910 -2.485546 1.267720
C -0.756758 0.937528 0.695597
C -4.048334 0.745796 -0.156177
C -0.406400 -2.068010 -0.146990
C -5.468794 0.743299 0.423125
C -0.127024 -3.220017 -1.117572
C -6.459072 1.422084 -0.519851
C 0.784389 -4.266850 -0.481071
H 1.997235 -0.968854 -0.423786
H 3.711226 -0.828894 -0.885309
H 1.359879 2.599389 0.436103
H 1.674837 1.297969 1.638053
H 3.401627 1.082786 -2.397003
H 1.621048 0.875118 -2.132173
H 4.135943 1.812848 1.297420
H 4.946709 1.394178 -0.213986
H 3.985501 2.867759 -0.122950
H 2.596656 -0.686314 1.989641
H 4.303466 -0.471211 1.577700
H -3.383727 -0.986552 1.019459
H -3.038057 0.600352 1.779458
H -2.272652 -1.482670 -1.145501
H -0.838772 -0.525746 -1.635547
H 3.732002 -2.852046 2.287327
H 2.694320 -3.019155 0.859757
H 4.438994 -2.784626 0.669801
H -4.038672 0.248991 -1.144527
H -3.717626 1.787259 -0.345129
H 0.557754 -1.575610 0.137093
H -0.835827 -2.455063 0.795771
H 1.617869 3.131952 -1.597544
H -5.476271 1.259839 1.404156
H -5.796604 -0.295629 0.623357
H -1.076425 -3.694836 -1.434083
H 0.340560 -2.829610 -2.043168
H -6.508070 0.916123 -1.490654
H -7.470771 1.421800 -0.098075
H -6.184942 2.466910 -0.708944
H 0.283768 -4.792691 0.339815
H 1.098546 -5.019847 -1.211717
H 1.698738 -3.808176 -0.062984


%chk=000212904-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212904

0 1
O 0.480502 0.644898 -0.015158
O 1.927248 2.520495 -2.129262
O -0.976539 1.658256 1.533240
N -1.704058 -0.079219 0.124153
C 2.873834 1.132920 -0.227833
C 3.330917 -0.337172 0.019819
C 1.584818 1.470991 0.548061
C 2.619525 1.277585 -1.760693
C 3.950344 2.159671 0.208831
C 3.784739 -0.689243 1.454946
C -3.075652 -0.039790 0.681007
C -1.366930 -1.110208 -0.884211
C 4.170272 -2.179528 1.585513
C -0.773828 0.804869 0.625762
C -4.039769 0.846722 -0.139921
C -0.745233 -2.382154 -0.261437
C -5.473643 0.835085 0.436784
C -0.400596 -3.452309 -1.321121
C -6.444509 1.727688 -0.365715
C 0.255897 -4.705850 -0.703312
H 2.497828 -1.012994 -0.264118
H 4.166884 -0.560123 -0.677420
H 1.322639 2.539071 0.443122
H 1.679914 1.248994 1.625223
H 3.587275 1.328253 -2.289648
H 2.055825 0.395787 -2.127538
H 4.028252 2.238623 1.308956
H 4.943493 1.866641 -0.179421
H 3.704986 3.159109 -0.193621
H 2.975256 -0.462054 2.176670
H 4.649497 -0.061026 1.744037
H -3.457787 -1.078801 0.723062
H -3.014161 0.343424 1.714662
H -2.300081 -1.370012 -1.420293
H -0.667505 -0.682400 -1.622993
H 4.498129 -2.424206 2.612427
H 3.311583 -2.833839 1.339746
H 4.995893 -2.438160 0.895653
H -4.060925 0.500909 -1.193864
H -3.648403 1.882334 -0.147306
H 0.172994 -2.091749 0.285257
H -1.444559 -2.808419 0.486366
H 0.971096 2.420225 -1.890169
H -5.444596 1.175058 1.491820
H -5.856697 -0.206332 0.454079
H -1.321461 -3.746582 -1.865796
H 0.281587 -3.012203 -2.077225
H -6.510518 1.395954 -1.419138
H -7.463669 1.701966 0.061520
H -6.104439 2.780096 -0.366342
H -0.414764 -5.180956 0.037008
H 0.495756 -5.459469 -1.475488
H 1.196837 -4.443431 -0.183177


