SMILES:[N+](=O)(c1ccc(CN2CCNCC2)cc1)[O-].Cl.Cl	

FORMULA: C11H17Cl2N3O2
MASS: 294.1776
EXACT MASS: 293.0697822
INTERATOMIC DISTANCES

              N   1      C   2      N   3      O   4      O   5      N   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    0.7711     0.0000 
   N   3    3.5564     2.8025     0.0000 
   O   4    0.7706     1.3375     3.8834     0.0000 
   O   5    0.7708     1.3365     4.1028     1.3313     0.0000 
   N   6    4.7260     4.0415     1.5583     4.8566     5.3780     0.0000 
   C   7    3.1087     2.3376     0.7667     3.5607     3.5591     2.3250 
   C   8    1.3375     0.7747     2.6922     2.0438     1.5437     4.1152 
   C   9    1.3438     0.7792     2.3313     1.5521     2.0490     3.3892 
   C  10    2.3299     1.5587     1.3422     2.8005     2.7966     2.8023 
   C  11    2.0536     1.3500     2.0543     2.6875     2.3257     3.5637 
   C  12    2.0568     1.3530     1.5525     2.3310     2.6895     2.6885 
  Cl  13    5.0426     4.2727     1.8002     5.5043     5.4376     2.4000 
  Cl  14    5.9101     5.1526     2.3544     6.2196     6.4349     1.8264 
   C  15    4.3228     3.5627     0.7783     4.6617     4.8445     1.3514 
   C  16    3.3834     2.6922     0.7747     3.5618     4.0286     1.3493 
   C  17    4.0394     3.3927     1.3493     4.1185     4.7230     0.7747 
   C  18    4.8535     4.1176     1.3514     5.0997     5.4356     0.7783 

              C   7      C   8      C   9      C  10      C  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    2.0649     0.0000 
   C   9    2.0592     1.3458     0.0000 
   C  10    0.7789     1.3500     1.3500     0.0000 
   C  11    1.3530     0.7820     1.5587     0.7792     0.0000 
   C  12    1.3500     1.5625     0.7789     0.7861     1.3572     0.0000 
  Cl  13    1.9452     3.9003     3.9853     2.7183     3.1245     3.2352 
  Cl  14    2.9004     4.9647     4.6704     3.6403     4.2413     3.8938 
   C  15    1.3371     3.3884     3.1096     2.0527     2.6900     2.3308 
   C  16    1.3350     2.8003     2.0555     1.5500     2.3292     1.3392 
   C  17    2.0503     3.5653     2.6957     2.3333     3.1125     2.0531 
   C  18    2.0517     4.0436     3.5653     2.6936     3.3910     2.8026 

             Cl  13     Cl  14      C  15      C  16      C  17      C  18
              ------------------------------------------------------------------
  Cl  13    0.0000 
  Cl  14    1.5169     0.0000 
   C  15    1.1997     1.5914     0.0000 
   C  16    2.5057     2.7275     1.3458     0.0000 
   C  17    2.7468     2.5158     1.5572     0.7833     0.0000 
   C  18    1.6449     1.1928     0.7833     1.5572     1.3458     0.0000 




ATOMIC CHARGES
   N   1    0.0809136614
   C   2    0.2900379366
   N   3   -0.2664407115
   O   4   -0.5760073424
   O   5    0.0414810530
   N   6   -0.2151149210
   C   7    0.0992210669
   C   8    0.0749900357
   C   9    0.0749900357
   C  10   -0.0057394921
   C  11    0.0033884000
   C  12    0.0033884000
  Cl  13    0.0000000000
  Cl  14    0.0000000000
   C  15    0.0914052632
   C  16    0.0914052632
   C  17    0.1060406756
   C  18    0.1060406756


BOND ANGLES
  18    6   17   C3   N3   C3    120.127
   6   17   16   N3   C3   C3    120.014
  11   10   12  Car  Car  Car    120.231
  10   12    9  Car  Car  Car    119.226
  12   10   11  Car  Car  Car    120.231
  10   11    8  Car  Car  Car    119.706
  17    6   18   C3   N3   C3    120.127
   6   18   15   N3   C3   C3    119.859


TORSION ANGLES
   8    2    1    4    179.974
   8    2    1    5      0.026
   9    2    1    4      0.026
   9    2    1    5    179.974
  15    3    7   10    179.974
  16    3    7   10      0.026
  18    6   17   16      0.026
   3    7   10   12      0.026
   3    7   10   11    179.974
  11    8    2    1    179.974
  11    8    2    9      0.026
  12    9    2    1    179.974
  12    9    2    8      0.026
   7   10   12    9    179.974
  11   10   12    9      0.026
  10   11    8    2      0.026
  10   12    9    2      0.026
  18   15    3    7    179.974
  18   15    3   16      0.026
  17   16    3    7    179.974
  17   16    3   15      0.026
   6   17   16    3      0.026
   6   18   15    3      0.026
   7   10   11    8    179.974
  12   10   11    8      0.026
  17    6   18   15      0.026


CHIRAL ATOMS
   N     3 is chiral: counterclockwise