Dibromomethyl pyridine-Val-Cit-PABC
                    3D
 Structure written by MMmdl.
 88 89  0  0  1  0            999 V2000
    7.1214    5.1460    6.7569 O   0  0  0  0  0  0
    2.2088   -1.0022    0.0000 O   0  0  0  0  0  0
    3.2274    3.4684    1.5142 O   0  0  0  0  0  0
   -0.9587    1.1234   -2.4402 O   0  0  0  0  0  0
    4.9495    4.9752   -3.6742 O   0  0  0  0  0  0
    1.9958    1.2377   -0.0000 N   0  0  0  0  0  0
   -0.4867   -0.6883   -1.1921 N   0  0  0  0  0  0
    4.6492    1.7898    1.9869 N   0  0  0  0  0  0
    5.1518    2.7331   -3.6742 N   0  0  0  0  0  0
    6.9747    3.9920   -3.6742 N   0  0  0  0  0  0
    6.7227    3.8365    6.9321 C   0  0  0  0  0  0
    6.1809    3.3017    5.6397 C   0  0  0  0  0  0
    6.2943    1.9480    5.3458 C   0  0  0  0  0  0
    5.5653    4.1597    4.7362 C   0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  1  0  0  0
   -0.5000   -0.7071    1.2247 C   0  0  0  0  0  0
    3.4145    1.5828   -0.0000 C   0  0  1  0  0  0
    5.7922    1.4524    4.1484 C   0  0  0  0  0  0
    5.0632    3.6641    3.5387 C   0  0  0  0  0  0
    5.1767    2.3105    3.2448 C   0  0  0  0  0  0
    3.7332    2.3880   -1.2247 C   0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  0  0  0  0
    3.7332    2.3880    1.2247 C   0  0  0  0  0  0
    3.4145    1.5828   -2.4495 C   0  0  0  0  0  0
   -2.0000   -0.7071    1.2247 C   0  0  0  0  0  0
    0.0000   -0.0000    2.4495 C   0  0  0  0  0  0
   -1.3503   -1.0957   -3.3376 C   0  0  0  0  0  0
   -0.1798   -1.4484   -4.2069 C   0  0  0  0  0  0
   -0.9225   -0.0960   -2.3044 C   0  0  0  0  0  0
    0.9107   -2.0378   -3.3622 C   0  0  0  0  0  0
    3.7332    2.3880   -3.6742 C   0  0  0  0  0  0
    2.0811   -2.3905   -4.2315 C   0  0  0  0  0  0
    3.1716   -2.9800   -3.3868 C   0  0  0  0  0  0
    5.6460    3.9667   -3.6742 C   0  0  0  0  0  0
    2.6638   -4.2164   -2.7062 C   0  0  0  0  0  0
    2.7877   -5.4641   -3.3171 C   0  0  0  0  0  0
    2.3085   -6.5993   -2.6656 C   0  0  0  0  0  0
    1.7187   -6.5369   -1.4451 N   0  0  0  0  0  0
    1.6044   -5.3154   -0.8614 C   0  0  0  0  0  0
    2.0602   -4.1381   -1.4529 C   0  0  0  0  0  0
    2.4300   -7.9523   -3.3017 C   0  0  0  0  0  0
    4.1588   -8.7718   -2.7540 Br  0  0  0  0  0  0
    0.9492   -5.2718    0.4872 C   0  0  0  0  0  0
   -1.0098   -5.0170    0.2469 Br  0  0  0  0  0  0
    7.4982    5.5858    7.5721 H   0  0  0  0  0  0
    1.4506    2.0879   -0.0000 H   0  0  0  0  0  0
   -0.4399   -1.6854   -1.0382 H   0  0  0  0  0  0
    5.0903    0.9034    1.7872 H   0  0  0  0  0  0
    5.6959    1.8846   -3.6742 H   0  0  0  0  0  0
    7.5755    3.1827   -3.6742 H   0  0  0  0  0  0
    7.5447    4.8242   -3.6742 H   0  0  0  0  0  0
    5.9477    3.7920    7.6972 H   0  0  0  0  0  0
    7.5767    3.2355    7.2445 H   0  0  0  0  0  0
    6.7736    1.2800    6.0493 H   0  0  0  0  0  0
    5.4769    5.2136    4.9650 H   0  0  0  0  0  0
   -0.3633    1.0277    0.0000 H   0  0  0  0  0  0
   -0.1367   -1.7348    1.2247 H   0  0  0  0  0  0
    4.0104    0.6701    0.0000 H   0  0  0  0  0  0
    5.8806    0.3985    3.9196 H   0  0  0  0  0  0
    4.5839    4.3322    2.8352 H   0  0  0  0  0  0
    4.7923    2.6456   -1.2247 H   0  0  0  0  0  0
    3.1373    3.3007   -1.2247 H   0  0  0  0  0  0
    2.3553    1.3252   -2.4495 H   0  0  0  0  0  0
    4.0104    0.6701   -2.4495 H   0  0  0  0  0  0
   -2.3633    0.3206    1.2247 H   0  0  0  0  0  0
   -2.3633   -1.2209    0.3348 H   0  0  0  0  0  0
   -2.3633   -1.2209    2.1147 H   0  0  0  0  0  0
   -0.3633    1.0277    2.4495 H   0  0  0  0  0  0
   -0.3633   -0.5138    3.3395 H   0  0  0  0  0  0
    1.0900   -0.0000    2.4495 H   0  0  0  0  0  0
   -1.7193   -1.9942   -2.8430 H   0  0  0  0  0  0
   -2.1427   -0.6674   -3.9514 H   0  0  0  0  0  0
    0.1892   -0.5499   -4.7015 H   0  0  0  0  0  0
   -0.4907   -2.1748   -4.9577 H   0  0  0  0  0  0
    0.5416   -2.9363   -2.8676 H   0  0  0  0  0  0
    1.2215   -1.3114   -2.6114 H   0  0  0  0  0  0
    3.5016    1.8029   -4.5642 H   0  0  0  0  0  0
    3.1373    3.3007   -3.6742 H   0  0  0  0  0  0
    2.4502   -1.4920   -4.7261 H   0  0  0  0  0  0
    1.7703   -3.1169   -4.9823 H   0  0  0  0  0  0
    3.4825   -2.2535   -2.6360 H   0  0  0  0  0  0
    4.0221   -3.2362   -4.0185 H   0  0  0  0  0  0
    3.2524   -5.5518   -4.2897 H   0  0  0  0  0  0
    1.9472   -3.1875   -0.9498 H   0  0  0  0  0  0
    2.4116   -7.8561   -4.3873 H   0  0  0  0  0  0
    1.6132   -8.5937   -2.9710 H   0  0  0  0  0  0
    1.3464   -4.4387    1.0672 H   0  0  0  0  0  0
    1.1224   -6.2092    1.0157 H   0  0  0  0  0  0
  1 11  1  0  0  0
  1 45  1  0  0  0
  2 22  2  0  0  0
  3 23  2  0  0  0
  4 29  2  0  0  0
  5 34  2  0  0  0
  6 17  1  0  0  0
  6 22  1  0  0  0
  6 46  1  0  0  0
  7 15  1  0  0  0
  7 29  1  0  0  0
  7 47  1  0  0  0
  8 20  1  0  0  0
  8 23  1  0  0  0
  8 48  1  0  0  0
  9 31  1  0  0  0
  9 34  1  0  0  0
  9 49  1  0  0  0
 10 34  1  0  0  0
 10 50  1  0  0  0
 10 51  1  0  0  0
 11 12  1  0  0  0
 11 52  1  0  0  0
 11 53  1  0  0  0
 12 13  2  0  0  0
 12 14  1  0  0  0
 13 18  1  0  0  0
 13 54  1  0  0  0
 14 19  2  0  0  0
 14 55  1  0  0  0
 15 16  1  0  0  0
 15 22  1  0  0  0
 15 56  1  0  0  0
 16 25  1  0  0  0
 16 26  1  0  0  0
 16 57  1  0  0  0
 17 21  1  0  0  0
 17 23  1  0  0  0
 17 58  1  0  0  0
 18 20  2  0  0  0
 18 59  1  0  0  0
 19 20  1  0  0  0
 19 60  1  0  0  0
 21 24  1  0  0  0
 21 61  1  0  0  0
 21 62  1  0  0  0
 24 31  1  0  0  0
 24 63  1  0  0  0
 24 64  1  0  0  0
 25 65  1  0  0  0
 25 66  1  0  0  0
 25 67  1  0  0  0
 26 68  1  0  0  0
 26 69  1  0  0  0
 26 70  1  0  0  0
 27 28  1  0  0  0
 27 29  1  0  0  0
 27 71  1  0  0  0
 27 72  1  0  0  0
 28 30  1  0  0  0
 28 73  1  0  0  0
 28 74  1  0  0  0
 30 32  1  0  0  0
 30 75  1  0  0  0
 30 76  1  0  0  0
 31 77  1  0  0  0
 31 78  1  0  0  0
 32 33  1  0  0  0
 32 79  1  0  0  0
 32 80  1  0  0  0
 33 35  1  0  0  0
 33 81  1  0  0  0
 33 82  1  0  0  0
 35 40  1  0  0  0
 35 36  2  0  0  0
 36 37  1  0  0  0
 36 83  1  0  0  0
 37 38  2  0  0  0
 37 41  1  0  0  0
 38 39  1  0  0  0
 39 40  2  0  0  0
 39 43  1  0  0  0
 40 84  1  0  0  0
 41 42  1  0  0  0
 41 85  1  0  0  0
 41 86  1  0  0  0
 43 44  1  0  0  0
 43 87  1  0  0  0
 43 88  1  0  0  0
M  END
> <s_m_entry_id>
91

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
