%chk=000208463.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208463

0 1
O -1.717832 1.746595 -0.559471
O 0.907936 -0.139428 -2.137493
N 4.723992 -0.632341 -0.786635
N 0.676646 0.610873 0.020913
C 3.878710 0.594967 -0.951318
C 3.143531 0.877848 0.372498
C 4.807605 -1.425141 -2.058958
C 6.088957 -0.279996 -0.269784
C 1.912642 -0.028097 0.539251
C -3.278573 3.010786 1.306881
C -3.379212 1.517873 1.076092
C -2.580133 0.875984 0.100975
C 3.482062 -2.139169 -2.319153
C 6.741327 -1.511161 0.362720
C -4.623960 3.693050 1.026544
C -2.792004 3.304738 2.732357
C -4.258574 0.713839 1.804886
C -2.644761 -0.495410 -0.142087
C 0.291756 0.504613 -1.298939
C -3.542821 -1.275277 0.608224
C -0.982539 1.257084 -1.696873
C -4.346231 -0.664942 1.579467
C -3.625562 -2.745074 0.356512
H 4.461992 1.486366 -1.259911
H 3.121704 0.423726 -1.757422
H 2.857386 1.944442 0.417920
H 3.829892 0.708138 1.226704
H 5.614335 -2.183279 -1.943183
H 5.083000 -0.799241 -2.935151
H 5.977748 0.509128 0.506567
H 6.751998 0.141502 -1.055973
H 2.084290 -0.996270 0.003474
H 1.748958 -0.275689 1.609643
H -2.523719 3.433556 0.589581
H 0.150375 1.202661 0.662453
H 3.527085 -2.739192 -3.231692
H 2.645217 -1.426459 -2.429972
H 3.217864 -2.800101 -1.485626
H 7.665387 -1.244647 0.883844
H 6.981983 -2.275374 -0.385251
H 6.063187 -1.981437 1.087720
H -5.400955 3.373802 1.728620
H -4.979748 3.458449 0.016544
H -4.538235 4.781819 1.104419
H -3.510345 2.967668 3.487100
H -2.638967 4.378529 2.882903
H -1.842069 2.799795 2.937640
H -4.892757 1.171185 2.565720
H -2.013546 -0.970756 -0.887330
H -1.617670 0.636228 -2.354633
H -0.725067 2.199321 -2.224188
H -5.043192 -1.259567 2.164007
H -3.982687 -2.952808 -0.663066
H -2.640860 -3.225109 0.456303
H -4.305949 -3.258897 1.047631


%chk=000208463-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208463

0 1
O -1.776120 1.563776 -0.654659
O 0.766844 -0.642727 -2.161001
N 4.757764 -0.497782 -0.780898
N 0.662900 0.443331 -0.082127
C 3.910388 0.724648 -0.724802
C 3.073415 0.789873 0.575431
C 5.053497 -0.927477 -2.180411
C 5.989112 -0.367105 0.046625
C 1.852839 -0.164274 0.546376
C -3.412782 3.059233 1.054791
C -3.557745 1.538046 0.958618
C -2.710984 0.788722 0.089474
C 3.924201 -1.769342 -2.802612
C 6.549482 -1.727665 0.503683
C -4.693685 3.773801 1.542075
C -2.206359 3.433771 1.963773
C -4.491264 0.800507 1.720581
C -2.794645 -0.616366 -0.010801
C 0.207548 0.151565 -1.342216
C -3.742746 -1.335753 0.762736
C -1.064184 0.917448 -1.764718
C -4.588677 -0.608227 1.630482
C -3.834859 -2.847904 0.647056
H 4.528669 1.653088 -0.821777
H 3.222134 0.707957 -1.589546
H 2.725659 1.828244 0.750185
H 3.714451 0.522285 1.437134
H 5.979935 -1.530863 -2.161058
H 5.272792 -0.041414 -2.827629
H 5.737660 0.227026 0.945392
H 6.783337 0.209091 -0.494100
H 2.118791 -1.073395 -0.020682
H 1.574876 -0.467336 1.573358
H -3.177269 3.427303 0.037294
H 0.106312 1.113235 0.458044
H 4.165569 -2.017556 -3.854289
H 2.951987 -1.247940 -2.783877
H 3.801959 -2.712143 -2.239785
H 7.451471 -1.586965 1.128855
H 6.831543 -2.364298 -0.354273
H 5.789704 -2.271980 1.091435
H -4.918747 3.537430 2.599317
H -5.572122 3.494304 0.932511
H -4.562640 4.869313 1.473626
H -2.369233 3.072820 2.996438
H -2.072075 4.531197 1.998453
H -1.269881 2.988726 1.582799
H -5.168671 1.336187 2.393843
H -2.121245 -1.173262 -0.671477
H -1.719537 0.230005 -2.328956
H -0.766708 1.744795 -2.431990
H -5.329272 -1.141673 2.237397
H -4.171479 -3.154247 -0.361673
H -2.853569 -3.327458 0.820598
H -4.548742 -3.262875 1.378982


