SMILES:[nH]1c(cc2c1ccc(c2)OC)C	

FORMULA: C10H11NO
MASS: 161.2004
EXACT MASS: 161.0840640
INTERATOMIC DISTANCES

              N   1      C   2      C   3      C   4      C   5      C   6
              ------------------------------------------------------------------
   N   1    0.0000 
   C   2    2.3167     0.0000 
   C   3    1.4160     2.3313     0.0000 
   C   4    2.3019     1.4318     1.4414     0.0000 
   C   5    1.4408     1.4315     2.3249     2.3128     0.0000 
   C   6    3.6563     1.4132     3.7254     2.6004     2.4650     0.0000 
   C   7    2.6075     2.4714     3.7169     3.6547     1.4142     2.8595 
   C   8    4.2757     2.4781     4.7478     3.8675     2.8570     1.4467 
   C   9    3.8627     2.8492     4.7321     4.2587     2.4641     2.4735 
   O  10    5.7015     3.7827     6.1018     5.0876     4.2856     2.4947 
   C  11    2.5562     3.7351     1.4481     2.5780     3.7303     5.0930 
   C  12    6.6027     4.9640     7.2145     6.3436     5.1624     3.8107 

              C   7      C   8      C   9      O  10      C  11      C  12
              ------------------------------------------------------------------
   C   7    0.0000 
   C   8    2.4843     0.0000 
   C   9    1.4395     1.4207     0.0000 
   O  10    3.7921     1.4286     2.4727     0.0000 
   C  11    5.0843     6.1834     6.1677     7.5178     0.0000 
   C  12    4.3125     2.4859     2.8731     1.4375     8.6569     0.0000 




ATOMIC CHARGES
   N   1   -0.2496546595
   C   2    0.0218217747
   C   3    0.0593858023
   C   4    0.0162939664
   C   5    0.0811172211
   C   6    0.0384332085
   C   7    0.0221965649
   C   8    0.1388318815
   C   9    0.0384441918
   O  10   -0.4714256625
   C  11    0.0520891323
   C  12    0.2524665784


BOND ANGLES
   4    2    5  Car  Car  Car    107.753
   2    5    1  Car  Car  Nar    107.519
   8    6    2  Car  Car  Car    120.105
   6    2    5  Car  Car  Car    120.111
   6    2    4  Car  Car  Car    132.136
   5    2    4  Car  Car  Car    107.753
   2    4    3  Car  Car  Car    108.468
   2    6    8  Car  Car  Car    120.105
   6    8    9  Car  Car  Car    119.222


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