#       Name:                   TL224M
#       Creating user name:     martin
#       Creation time:          Sat Apr 23 14:16:54 1994

#       Modifying user name:    martin
#       Modification time:      Sun Apr 21 19:36:31 1996

@<TRIPOS>MOLECULE
TL224M
   33    35     1     0     0
SMALL
USER_CHARGES


@<TRIPOS>ATOM
      1 O1          1.1020    3.6150   -0.4070 O.3       1 <1>        -0.5250
      2 C2          1.2790    2.2980   -0.1100 C.ar      1 <1>         0.3560
      3 C3          2.5620    1.7790    0.0786 C.ar      1 <1>        -0.3190
      4 C4          2.7550    0.4350    0.3880 C.ar      1 <1>         0.0163
      5 C5          1.6620   -0.4270    0.5150 C.ar      1 <1>        -0.4490
      6 C6          1.9190   -1.8830    0.8470 C.3       1 <1>         0.4050
      7 C7          2.5210   -2.6010   -0.3730 C.3       1 <1>        -0.0465
      8 C8          2.7120   -4.0934   -0.0779 C.3       1 <1>        -0.2230
      9 C9          1.3950   -4.7160    0.3980 C.3       1 <1>         0.2090
     10 N10         0.8790   -4.0233    1.5740 N.3       1 <1>        -0.7630
     11 C11         0.6560   -2.5910    1.3670 C.3       1 <1>         0.1440
     12 C12        -0.5340   -2.2980    0.4450 C.3       1 <1>        -0.0461
     13 C13        -0.8470   -0.7980    0.4710 C.3       1 <1>        -0.4230
     14 C14         0.3710    0.0846    0.3250 C.ar      1 <1>         0.2210
     15 C15         0.1750    1.4410    0.0156 C.ar      1 <1>         0.1620
     16 O16        -1.0785    1.9480   -0.1540 O.3       1 <1>        -0.4870
     17 H17         1.9670    4.0558   -0.4430 H         1 <1>         0.3380
     18 H18         3.4360    2.4460   -0.0167 H         1 <1>         0.1100
     19 H19         3.7810    0.0586    0.5330 H         1 <1>         0.0718
     20 H20         2.6750   -1.9200    1.6690 H         1 <1>        -0.0278
     21 H21         1.8560   -2.4810   -1.2600 H         1 <1>         0.0449
     22 H22         3.5040   -2.1510   -0.6510 H         1 <1>         0.0174
     23 H23         3.0823   -4.6230   -0.9880 H         1 <1>         0.0544
     24 H24         3.4880   -4.2180    0.7150 H         1 <1>         0.0757
     25 H25         1.5630   -5.7870    0.6630 H         1 <1>         0.0303
     26 H26         0.6360   -4.7030   -0.4180 H         1 <1>        -0.0221
     27 H27         0.0120   -4.4620    1.8710 H         1 <1>         0.3130
     28 H28         0.4030   -2.1640    2.3690 H         1 <1>         0.0427
     29 H29        -0.3130   -2.6050   -0.6020 H         1 <1>         0.0790
     30 H30        -1.4340   -2.8760    0.7660 H         1 <1>         0.0523
     31 H31        -1.3280   -0.5380    1.4440 H         1 <1>         0.1280
     32 H32        -1.5860   -0.5750   -0.3340 H         1 <1>         0.1230
     33 H33        -1.0119    2.9000   -0.3340 H         1 <1>         0.3380
@<TRIPOS>BOND
     1    1    2 1  
     2    2    3 ar  
     3    2   15 ar  
     4    3    4 ar  
     5    4    5 ar  
     6    5    6 1   
     7    5   14 ar  
     8    6    7 1   
     9    6   11 1   
    10    7    8 1   
    11    8    9 1   
    12    9   10 1   
    13   10   11 1   
    14   11   12 1   
    15   12   13 1   
    16   13   14 1   
    17   14   15 ar  
    18   15   16 1   
    19    1   17 1   
    20    3   18 1   
    21    4   19 1   
    22    6   20 1   
    23    7   21 1   
    24    7   22 1   
    25    8   23 1   
    26    8   24 1   
    27    9   25 1   
    28    9   26 1   
    29   10   27 1   
    30   11   28 1   
    31   12   29 1   
    32   12   30 1   
    33   13   31 1   
    34   13   32 1   
    35   16   33 1   
@<TRIPOS>SUBSTRUCTURE
     1 ****        1 TEMP              0 ****  ****    0 ROOT

Last updated: March 15, 2001