%chk=000213321.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213321

0 1
O 4.969579 1.044348 -0.570664
O 3.976379 0.099092 -2.335322
N -0.584869 -1.371785 -0.277648
C -1.876472 -0.797337 -0.383939
C 0.593643 -0.719807 0.225196
C -0.651165 -2.717383 -0.700933
C 0.695044 -0.348253 1.590521
C -2.728597 -1.786382 -0.876531
C -1.969280 -2.975657 -1.074069
C -2.190339 0.589123 -0.044135
C 1.646365 -0.471103 -0.665804
C 0.525197 -3.610826 -0.714525
C 1.871153 0.285450 2.024833
C 2.812850 0.153103 -0.201173
C -0.412894 -0.608948 2.547661
C 2.922129 0.535814 1.144666
C -3.340469 0.863893 0.717644
C -1.380316 1.649815 -0.483139
C -3.668258 2.182666 1.038752
C -1.713571 2.966127 -0.155106
C 3.906229 0.391826 -1.163014
C -2.855087 3.235615 0.606545
H -3.773109 -1.671505 -1.087378
H -2.351565 -3.902289 -1.449937
H 1.563220 -0.760030 -1.720108
H 1.164349 -3.483065 0.171158
H 0.218181 -4.667571 -0.742588
H 1.153783 -3.435943 -1.602172
H 1.962760 0.586101 3.069374
H -1.225550 0.128900 2.413099
H -0.872972 -1.598859 2.393075
H -0.097683 -0.556167 3.597381
H 3.835246 1.028493 1.493148
H -3.975573 0.044613 1.051773
H -0.498245 1.446023 -1.088852
H -4.561199 2.391341 1.625898
H -1.083450 3.785171 -0.498922
H -3.112667 4.262235 0.858359
H 5.711220 1.209464 -1.213924


%chk=000213321-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213321

0 1
O 5.073539 1.018934 -0.641544
O 3.894113 0.160143 -2.448773
N -0.582820 -1.339392 -0.294514
C -1.890272 -0.784136 -0.325166
C 0.614357 -0.706797 0.206480
C -0.641603 -2.701477 -0.668113
C 0.744468 -0.410072 1.597103
C -2.757686 -1.814117 -0.728218
C -1.982909 -3.000699 -0.941881
C -2.220071 0.620613 -0.031717
C 1.663796 -0.432210 -0.692146
C 0.569790 -3.590661 -0.697126
C 1.954449 0.190999 2.033502
C 2.866598 0.156342 -0.231785
C -0.362784 -0.719389 2.580508
C 3.006732 0.475353 1.142782
C -3.485290 0.924888 0.553002
C -1.348075 1.705975 -0.336524
C -3.863723 2.256635 0.819072
C -1.723488 3.037106 -0.055707
C 3.941327 0.421313 -1.221806
C -2.981712 3.323290 0.522757
H -3.825572 -1.693493 -0.904973
H -2.350709 -3.972041 -1.269756
H 1.552763 -0.659057 -1.757337
H 1.105775 -3.603973 0.271235
H 0.254233 -4.622690 -0.922581
H 1.302889 -3.288569 -1.468870
H 2.068173 0.429005 3.097198
H -1.148465 0.058881 2.542567
H -0.857178 -1.677944 2.345184
H 0.024939 -0.760195 3.612379
H 3.934863 0.933237 1.495204
H -4.162642 0.103035 0.811262
H -0.386302 1.513473 -0.820696
H -4.842108 2.462503 1.268244
H -1.035829 3.853792 -0.303251
H -3.271716 4.358026 0.736084
H 5.752146 1.169669 -1.352880


