Mc-Asn-Pro-Val-PABC
                    3D
 Structure written by MMmdl.
 87 89  0  0  1  0            999 V2000
  -12.1505    2.7672   -3.8976 O   0  0  0  0  0  0
  -11.9578    1.4007   -3.8894 C   0  0  0  0  0  0
  -10.4946    1.1031   -3.7460 C   0  0  0  0  0  0
   -9.6974    0.9748   -4.8772 C   0  0  0  0  0  0
   -8.3417    0.6989   -4.7443 C   0  0  0  0  0  0
   -7.7832    0.5514   -3.4802 C   0  0  0  0  0  0
   -8.5805    0.6797   -2.3490 C   0  0  0  0  0  0
   -9.9361    0.9555   -2.4818 C   0  0  0  0  0  0
   -6.3591    0.2617   -3.3406 N   0  0  0  0  0  0
   -5.7115    0.0993   -2.1864 C   0  0  0  0  0  0
   -4.2546   -0.1871   -2.3998 C   0  0  1  0  0  0
   -6.2655    0.1799   -1.0940 O   0  0  0  0  0  0
   -3.4867    0.3293   -1.2706 N   0  0  0  0  0  0
   -4.0472   -1.6686   -2.5098 C   0  0  0  0  0  0
   -4.5076   -2.3331   -1.2462 C   0  0  0  0  0  0
   -2.5904   -1.9550   -2.7231 C   0  0  0  0  0  0
   -2.5241    1.2490   -1.3447 C   0  0  0  0  0  0
   -1.9388    1.5537    0.0023 C   0  0  1  0  0  0
   -2.1780    1.7682   -2.4018 O   0  0  0  0  0  0
   -0.5040    1.2482    0.0000 N   0  0  0  0  0  0
    0.3518    2.4371   -0.0019 C   0  0  0  0  0  0
   -0.6412    3.5610   -0.2929 C   0  0  0  0  0  0
   -1.9593    3.0560    0.2783 C   0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0
    1.5000    0.0000    0.0000 C   0  0  2  0  0  0
   -0.6996   -1.0172   -0.0001 O   0  0  0  0  0  0
    2.0000   -0.0000   -1.4142 C   0  0  0  0  0  0
    1.5000   -1.2247   -2.1213 C   0  0  0  0  0  0
    2.3453   -2.2484   -1.9977 N   0  0  0  0  0  0
    0.4455   -1.3024   -2.7448 O   0  0  0  0  0  0
    1.9867   -1.1921    0.6883 N   0  0  0  0  0  0
    2.7565   -1.1976    1.7769 C   0  0  0  0  0  0
    3.0752   -2.5923    2.2277 C   0  0  0  0  0  0
    3.1439   -0.1697    2.3248 O   0  0  0  0  0  0
    3.9406   -2.5367    3.4516 C   0  0  0  0  0  0
    4.2594   -3.9314    3.9023 C   0  0  0  0  0  0
    5.1248   -3.8759    5.1262 C   0  0  0  0  0  0
    5.4435   -5.2706    5.5770 C   0  0  0  0  0  0
    6.1508   -5.9764    4.5124 N   0  0  0  0  0  0
    5.5356   -6.6847    3.5685 C   0  0  0  0  0  0
    6.5781   -7.2001    2.7418 C   0  0  0  0  0  0
    7.7480   -6.7730    3.2360 C   0  0  0  0  0  0
    7.4758   -5.9765    4.3880 C   0  0  0  0  0  0
    4.3214   -6.8471    3.4528 O   0  0  0  0  0  0
    8.2779   -5.4028    5.1239 O   0  0  0  0  0  0
  -13.1025    3.0592   -3.9902 H   0  0  0  0  0  0
  -12.3250    0.9764   -4.8238 H   0  0  0  0  0  0
  -12.5015    0.9622   -3.0527 H   0  0  0  0  0  0
  -10.1322    1.0896   -5.8613 H   0  0  0  0  0  0
   -7.7211    0.5991   -5.6250 H   0  0  0  0  0  0
   -8.1456    0.5648   -1.3648 H   0  0  0  0  0  0
  -10.5568    1.0554   -1.6011 H   0  0  0  0  0  0
   -5.9437    0.2040   -4.2593 H   0  0  0  0  0  0
   -3.9201    0.2958   -3.3179 H   0  0  0  0  0  0
   -3.8022   -0.1225   -0.4242 H   0  0  0  0  0  0
   -4.6206   -2.0542   -3.3528 H   0  0  0  0  0  0
   -3.9343   -1.9475   -0.4032 H   0  0  0  0  0  0
   -5.5663   -2.1250   -1.0912 H   0  0  0  0  0  0
   -4.3569   -3.4097   -1.3261 H   0  0  0  0  0  0
   -2.0170   -1.5695   -1.8801 H   0  0  0  0  0  0
   -2.4396   -3.0316   -2.8030 H   0  0  0  0  0  0
   -2.2558   -1.4722   -3.6413 H   0  0  0  0  0  0
   -2.4903    0.9846    0.7540 H   0  0  0  0  0  0
    1.1497    2.3883   -0.7467 H   0  0  0  0  0  0
    0.8063    2.5693    0.9826 H   0  0  0  0  0  0
   -0.7315    3.7034   -1.3719 H   0  0  0  0  0  0
   -0.3308    4.5149    0.1366 H   0  0  0  0  0  0
   -2.8284    3.5496   -0.1596 H   0  0  0  0  0  0
   -1.9924    3.2325    1.3555 H   0  0  0  0  0  0
    1.8633    0.8900    0.5138 H   0  0  0  0  0  0
    3.0900   -0.0000   -1.4142 H   0  0  0  0  0  0
    1.6367    0.8900   -1.9280 H   0  0  0  0  0  0
    2.2131   -3.1691   -2.3915 H   0  0  0  0  0  0
    3.2213   -2.2284   -1.4953 H   0  0  0  0  0  0
    1.6461   -2.0119    0.2066 H   0  0  0  0  0  0
    3.6032   -3.1192    1.4329 H   0  0  0  0  0  0
    2.1499   -3.1192    2.4606 H   0  0  0  0  0  0
    3.4126   -2.0098    4.2463 H   0  0  0  0  0  0
    4.8659   -2.0098    3.2186 H   0  0  0  0  0  0
    4.7874   -4.4584    3.1076 H   0  0  0  0  0  0
    3.3340   -4.4584    4.1352 H   0  0  0  0  0  0
    4.5968   -3.3489    5.9210 H   0  0  0  0  0  0
    6.0501   -3.3489    4.8933 H   0  0  0  0  0  0
    4.5182   -5.7975    5.8099 H   0  0  0  0  0  0
    6.0724   -5.2302    6.4663 H   0  0  0  0  0  0
    6.4183   -7.8241    1.8744 H   0  0  0  0  0  0
    8.7378   -6.9774    2.8541 H   0  0  0  0  0  0
  1  2  1  0  0  0
  1 46  1  0  0  0
  2  3  1  0  0  0
  2 47  1  0  0  0
  2 48  1  0  0  0
  3  8  1  0  0  0
  3  4  2  0  0  0
  4  5  1  0  0  0
  4 49  1  0  0  0
  5  6  2  0  0  0
  5 50  1  0  0  0
  6  7  1  0  0  0
  6  9  1  0  0  0
  7  8  2  0  0  0
  7 51  1  0  0  0
  8 52  1  0  0  0
  9 10  1  0  0  0
  9 53  1  0  0  0
 10 11  1  0  0  0
 10 12  2  0  0  0
 11 13  1  0  0  0
 11 14  1  0  0  0
 11 54  1  0  0  0
 13 17  1  0  0  0
 13 55  1  0  0  0
 14 15  1  0  0  0
 14 16  1  0  0  0
 14 56  1  0  0  0
 15 57  1  0  0  0
 15 58  1  0  0  0
 15 59  1  0  0  0
 16 60  1  0  0  0
 16 61  1  0  0  0
 16 62  1  0  0  0
 17 18  1  0  0  0
 17 19  2  0  0  0
 18 23  1  0  0  0
 18 20  1  0  0  0
 18 63  1  0  0  0
 20 21  1  0  0  0
 20 24  1  0  0  0
 21 22  1  0  0  0
 21 64  1  0  0  0
 21 65  1  0  0  0
 22 23  1  0  0  0
 22 66  1  0  0  0
 22 67  1  0  0  0
 23 68  1  0  0  0
 23 69  1  0  0  0
 24 25  1  0  0  0
 24 26  2  0  0  0
 25 27  1  0  0  0
 25 31  1  0  0  0
 25 70  1  0  0  0
 27 28  1  0  0  0
 27 71  1  0  0  0
 27 72  1  0  0  0
 28 29  1  0  0  0
 28 30  2  0  0  0
 29 73  1  0  0  0
 29 74  1  0  0  0
 31 32  1  0  0  0
 31 75  1  0  0  0
 32 33  1  0  0  0
 32 34  2  0  0  0
 33 35  1  0  0  0
 33 76  1  0  0  0
 33 77  1  0  0  0
 35 36  1  0  0  0
 35 78  1  0  0  0
 35 79  1  0  0  0
 36 37  1  0  0  0
 36 80  1  0  0  0
 36 81  1  0  0  0
 37 38  1  0  0  0
 37 82  1  0  0  0
 37 83  1  0  0  0
 38 39  1  0  0  0
 38 84  1  0  0  0
 38 85  1  0  0  0
 39 43  1  0  0  0
 39 40  1  0  0  0
 40 41  1  0  0  0
 40 44  2  0  0  0
 41 42  2  0  0  0
 41 86  1  0  0  0
 42 43  1  0  0  0
 42 87  1  0  0  0
 43 45  2  0  0  0
M  END
> <s_m_entry_id>
24

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
