%chk=000208524.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208524

1 1
O -0.075527 1.160414 0.839332
N 2.811208 0.051148 -0.326305
C 1.624802 -0.696201 -0.942385
C 3.990487 -0.918547 -0.129167
C 2.490458 0.554832 1.090147
C -0.665959 0.260874 -0.132175
C 0.408597 0.180217 -1.245689
C -2.003563 0.871440 -0.654732
C 4.758438 -0.414927 1.099032
C 3.799848 0.499721 1.879581
C 3.242099 1.241752 -1.194933
C -1.782347 2.249819 -1.307639
C -3.013201 0.980225 0.508022
C -3.110296 2.871996 -1.762089
C -4.332961 1.614323 0.053636
C -0.907197 -1.094026 0.520188
C -4.105642 2.981332 -0.601353
C 3.650956 0.848319 -2.601787
C -1.378860 -2.164954 -0.255137
C -0.677921 -1.280986 1.889242
C -1.614275 -3.408362 0.336485
C -0.914836 -2.526709 2.478622
C -1.381663 -3.592320 1.703975
H 1.974474 -1.179681 -1.885241
H 1.338147 -1.530312 -0.251601
H 4.624573 -0.957731 -1.040970
H 3.607282 -1.948995 0.042360
H 1.700601 -0.090969 1.546413
H 2.032474 1.570150 1.055929
H -0.076627 -0.208401 -2.169216
H 0.716387 1.220404 -1.496535
H -2.431015 0.180167 -1.421929
H 5.102982 -1.263818 1.723207
H 5.679392 0.127168 0.808970
H 3.623072 0.115807 2.904642
H 4.235884 1.507873 2.019650
H 4.085032 1.760023 -0.676889
H 2.391396 1.969039 -1.230601
H -1.109179 2.164352 -2.179958
H -1.280242 2.930133 -0.592302
H -2.573118 1.580327 1.331424
H -3.216767 -0.023923 0.932048
H -2.924681 3.874071 -2.195071
H -3.552561 2.267790 -2.578351
H -4.851399 0.939128 -0.655617
H -5.015079 1.718615 0.920188
H -5.068338 3.389857 -0.966353
H -3.737482 3.706770 0.149143
H 2.821211 0.452833 -3.203120
H 4.467734 0.112510 -2.629295
H 4.025077 1.732429 -3.149667
H -0.786477 1.630349 1.347246
H -1.580108 -2.031625 -1.317056
H -0.328483 -0.449712 2.502606
H -1.989827 -4.236165 -0.267180
H -0.745032 -2.664128 3.547348
H -1.573546 -4.562312 2.165201


%chk=000208524-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208524

1 1
O 0.046380 1.340105 0.706588
N 2.806765 -0.100877 -0.279391
C 1.650907 -0.735111 -1.090704
C 4.084826 -0.942553 -0.491090
C 2.615983 -0.214389 1.253689
C -0.621918 0.316938 -0.142795
C 0.366194 0.082994 -1.321206
C -1.994036 0.892839 -0.676988
C 5.004918 -0.596209 0.696794
C 4.040426 -0.147292 1.847347
C 3.035765 1.385869 -0.642796
C -1.841644 2.097957 -1.644766
C -2.949162 1.265665 0.493162
C -3.217335 2.602192 -2.149551
C -4.324649 1.752973 -0.024235
C -0.877281 -0.982767 0.651959
C -4.169086 2.952722 -0.985272
C 3.404329 1.647515 -2.108311
C -1.347261 -2.140848 -0.024770
C -0.690194 -1.052361 2.054070
C -1.616658 -3.334123 0.680490
C -0.965686 -2.243948 2.764508
C -1.426966 -3.391276 2.081033
H 2.088878 -0.968420 -2.077487
H 1.420568 -1.689378 -0.585830
H 4.508057 -0.729127 -1.483405
H 3.763133 -1.997885 -0.463829
H 2.143043 -1.193396 1.435844
H 1.917899 0.573299 1.569499
H -0.178333 -0.479292 -2.104844
H 0.602771 1.062173 -1.767653
H -2.478192 0.064418 -1.236193
H 5.606408 -1.474528 0.980514
H 5.711966 0.208077 0.434604
H 4.111985 -0.814917 2.721095
H 4.288904 0.867642 2.198746
H 3.838062 1.742132 0.024410
H 2.102648 1.896856 -0.354228
H -1.228769 1.825837 -2.525226
H -1.313340 2.922872 -1.123610
H -2.513905 2.097866 1.095462
H -3.079465 0.404578 1.173716
H -3.069354 3.482164 -2.803539
H -3.685140 1.815610 -2.776814
H -4.829003 0.918363 -0.552441
H -4.969053 2.022758 0.833095
H -5.156562 3.256684 -1.379261
H -3.767062 3.823106 -0.426854
H 2.638245 1.290499 -2.816882
H 4.378164 1.214912 -2.393939
H 3.488707 2.740040 -2.245471
H -0.648095 1.820066 1.226395
H -1.520899 -2.118224 -1.108025
H -0.333846 -0.170103 2.596603
H -1.982646 -4.214063 0.140681
H -0.827555 -2.272286 3.850854
H -1.644433 -4.312945 2.630543


