Trastuzumab-AJICAP-maytansinoid
                    3D
 Structure written by MMmdl.
139144  0  0  1  0            999 V2000
   -0.9851    7.3998    1.2607 Cl  0  0  0  0  0  0
    3.9750    1.0746    3.3700 O   0  0  0  0  0  0
    1.5060    1.2218    1.9862 O   0  0  0  0  0  0
    2.9328   -0.7738    7.7777 O   0  0  0  0  0  0
   -0.0925   -1.9085    6.7567 O   0  0  0  0  0  0
   -1.8948   -0.7871    8.6788 O   0  0  0  0  0  0
    2.3229    5.0037    3.5553 O   0  0  0  0  0  0
    2.7067   -1.4777    9.9241 O   0  0  0  0  0  0
    2.6672    2.1141    0.2471 O   0  0  0  0  0  0
   -2.0005   -1.0298   -0.0000 O   0  0  0  0  0  0
   -3.9068    6.9647    1.1699 O   0  0  0  0  0  0
    0.8181   -1.0940    8.6585 N   0  0  0  0  0  0
    0.2078    5.6381    3.3656 N   0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0
    2.8967    1.9353    3.7498 C   0  0  2  0  0  0
    2.9869    0.5057    4.2365 C   0  0  2  0  0  0
    3.4606    0.1657    5.6348 C   0  0  1  0  0  0
    1.9754    2.3542    2.6199 C   0  0  2  0  0  0
    2.4023   -0.5751    6.4704 C   0  0  2  0  0  0
    3.3340    3.0282    4.6796 C   0  0  0  0  0  0
    4.6882   -0.6885    5.5197 C   0  0  0  0  0  0
    1.0580    0.1516    6.5673 C   0  0  0  0  0  0
    0.7839    3.2212    3.0829 C   0  0  0  0  0  0
    0.1398   -0.7226    7.4231 C   0  0  1  0  0  0
   -1.2148   -0.0588    7.7241 C   0  0  1  0  0  0
    1.1534    4.6895    3.3620 C   0  0  0  0  0  0
    2.1930   -1.1529    8.8613 C   0  0  0  0  0  0
    1.9600    1.2247    0.7071 C   0  0  0  0  0  0
    1.4600    0.0000    0.0000 C   0  0  2  0  0  0
   -2.1002   -0.0016    6.4956 C   0  0  0  0  0  0
   -1.1906    5.4885    3.2033 C   0  0  0  0  0  0
    0.7210    7.0048    3.3433 C   0  0  0  0  0  0
    1.9600    0.0000   -1.4142 C   0  0  0  0  0  0
   -2.6387    1.1175    5.9856 C   0  0  0  0  0  0
   -3.1192   -1.2789    8.2746 C   0  0  0  0  0  0
   -1.9339    4.6168    4.0304 C   0  0  0  0  0  0
   -1.8616    6.2912    2.2545 C   0  0  0  0  0  0
   -0.4753    1.3805   -0.0000 C   0  0  0  0  0  0
   -0.7743   -1.0855   -0.0000 C   0  0  0  0  0  0
   -3.4738    1.0969    4.7997 C   0  0  0  0  0  0
   -3.3339    4.5243    3.8912 C   0  0  0  0  0  0
   -4.1178    3.5838    4.7842 C   0  0  0  0  0  0
   -4.1075    2.1577    4.2662 C   0  0  0  0  0  0
   -3.2579    6.1892    2.1090 C   0  0  0  0  0  0
   -3.9945    5.3061    2.9218 C   0  0  0  0  0  0
    0.0354   -2.3482   -0.0000 C   0  0  0  0  0  0
   -4.8987    1.9442    3.0098 C   0  0  0  0  0  0
   -0.7257   -3.4302   -0.7071 C   0  0  0  0  0  0
   -5.2739    6.7865    1.1103 C   0  0  0  0  0  0
   -0.9884   -3.0205   -2.0836 N   0  0  0  0  0  0
   -2.0630   -2.3502   -2.5002 C   0  0  0  0  0  0
   -2.0198   -2.0892   -3.9767 C   0  0  1  0  0  0
   -2.9651   -2.0006   -1.7448 O   0  0  0  0  0  0
   -2.6643   -3.2731   -4.7255 C   0  0  0  0  0  0
   -4.1792   -3.3656   -4.4530 C   0  0  0  0  0  0
   -4.8975   -2.0359   -4.7596 C   0  0  2  0  0  0
   -4.2530   -0.8520   -4.0108 C   0  0  0  0  0  0
   -2.7381   -0.7595   -4.2833 C   0  0  0  0  0  0
   -6.3500   -2.1418   -4.4002 C   0  0  0  0  0  0
   -7.0264   -0.8919   -4.7346 N   0  0  0  0  0  0
   -7.6526   -0.1348   -3.8370 C   0  0  0  0  0  0
   -8.1674    0.9752   -4.5708 C   0  0  0  0  0  0
   -7.8217    0.8185   -5.8558 C   0  0  0  0  0  0
   -7.0792   -0.3947   -5.9679 C   0  0  0  0  0  0
   -7.7535   -0.3639   -2.6323 O   0  0  0  0  0  0
   -6.5841   -0.8938   -6.9778 O   0  0  0  0  0  0
   -8.1957    1.9000   -7.2192 S   0  0  0  0  0  0
   -6.4701    2.1682   -7.5638 C   0  0  0  0  0  0
   -6.3323    3.0956   -8.7347 C   0  0  0  0  0  0
   -6.9878    4.4062   -8.4143 C   0  0  0  0  0  0
   -6.4000    5.4222   -9.0468 N   0  0  0  0  0  0
   -7.9489    4.5536   -7.6651 O   0  0  0  0  0  0
    0.2317   -2.7287    7.2281 H   0  0  0  0  0  0
    0.2710   -1.3660    9.4620 H   0  0  0  0  0  0
    2.3847   -0.2555    3.7438 H   0  0  0  0  0  0
    3.7673    1.0821    6.1406 H   0  0  0  0  0  0
    2.5671    2.8915    1.8770 H   0  0  0  0  0  0
    2.2367   -1.5570    6.0260 H   0  0  0  0  0  0
    2.4773    3.6515    4.9359 H   0  0  0  0  0  0
    3.7483    2.5890    5.5871 H   0  0  0  0  0  0
    4.0940    3.6381    4.1914 H   0  0  0  0  0  0
    4.4351   -1.6226    5.0182 H   0  0  0  0  0  0
    5.4460   -0.1596    4.9418 H   0  0  0  0  0  0
    5.0755   -0.9041    6.5155 H   0  0  0  0  0  0
    0.6189    0.3055    5.5810 H   0  0  0  0  0  0
    1.1903    1.1368    7.0177 H   0  0  0  0  0  0
    0.3297    2.7837    3.9713 H   0  0  0  0  0  0
    0.0278    3.2065    2.2967 H   0  0  0  0  0  0
   -1.0733    0.9401    8.1400 H   0  0  0  0  0  0
    1.8233   -0.8900    0.5138 H   0  0  0  0  0  0
   -2.3025   -0.9528    6.0230 H   0  0  0  0  0  0
   -0.1133    7.7063    3.3478 H   0  0  0  0  0  0
    1.3426    7.1739    4.2225 H   0  0  0  0  0  0
    1.3167    7.1546    2.4428 H   0  0  0  0  0  0
    3.0500   -0.0000   -1.4142 H   0  0  0  0  0  0
    1.5967   -0.8900   -1.9280 H   0  0  0  0  0  0
    1.5967    0.8900   -1.9280 H   0  0  0  0  0  0
   -2.4212    2.0547    6.4756 H   0  0  0  0  0  0
   -3.5751   -1.8360    9.0930 H   0  0  0  0  0  0
   -3.7687   -0.4500    7.9932 H   0  0  0  0  0  0
   -2.9809   -1.9390    7.4184 H   0  0  0  0  0  0
   -1.4394    4.0271    4.7874 H   0  0  0  0  0  0
   -1.5653    1.3894   -0.0000 H   0  0  0  0  0  0
   -0.1078    1.8913    0.8900 H   0  0  0  0  0  0
   -0.1078    1.8913   -0.8900 H   0  0  0  0  0  0
   -3.5853    0.1540    4.2816 H   0  0  0  0  0  0
   -5.1545    3.9169    4.8450 H   0  0  0  0  0  0
   -3.7315    3.6488    5.8005 H   0  0  0  0  0  0
   -5.0668    5.2406    2.8026 H   0  0  0  0  0  0
    0.2315   -2.6540    1.0277 H   0  0  0  0  0  0
    0.9807   -2.1736   -0.5138 H   0  0  0  0  0  0
   -5.3507    2.8867    2.7006 H   0  0  0  0  0  0
   -4.2385    1.5821    2.2217 H   0  0  0  0  0  0
   -5.6819    1.2089    3.1941 H   0  0  0  0  0  0
   -1.6710   -3.6048   -0.1933 H   0  0  0  0  0  0
   -0.1373   -4.3478   -0.7071 H   0  0  0  0  0  0
   -5.6922    7.4387    0.3436 H   0  0  0  0  0  0
   -5.4946    5.7480    0.8637 H   0  0  0  0  0  0
   -5.7148    7.0322    2.0764 H   0  0  0  0  0  0
   -0.2247   -3.3269   -2.6693 H   0  0  0  0  0  0
   -0.9631   -2.0121   -4.2382 H   0  0  0  0  0  0
   -2.1756   -4.2063   -4.4404 H   0  0  0  0  0  0
   -2.4948   -3.1596   -5.7980 H   0  0  0  0  0  0
   -4.3441   -3.6344   -3.4078 H   0  0  0  0  0  0
   -4.6169   -4.1718   -5.0441 H   0  0  0  0  0  0
   -4.8661   -1.8460   -5.8342 H   0  0  0  0  0  0
   -4.4225   -0.9655   -2.9383 H   0  0  0  0  0  0
   -4.7418    0.0813   -4.2959 H   0  0  0  0  0  0
   -2.5732   -0.4907   -5.3285 H   0  0  0  0  0  0
   -2.3004    0.0467   -3.6922 H   0  0  0  0  0  0
   -6.4468   -2.3327   -3.3314 H   0  0  0  0  0  0
   -6.8035   -2.9610   -4.9581 H   0  0  0  0  0  0
   -8.7343    1.7856   -4.1357 H   0  0  0  0  0  0
   -5.9938    1.2158   -7.7966 H   0  0  0  0  0  0
   -5.9899    2.6109   -6.6912 H   0  0  0  0  0  0
   -6.8125    2.6529   -9.6073 H   0  0  0  0  0  0
   -5.2756    3.2598   -8.9457 H   0  0  0  0  0  0
   -6.6738    6.3921   -8.9796 H   0  0  0  0  0  0
   -5.6092    5.3462   -9.6704 H   0  0  0  0  0  0
  1 37  1  0  0  0
  2 15  1  0  0  0
  2 16  1  0  0  0
  3 18  1  0  0  0
  3 28  1  0  0  0
  4 19  1  0  0  0
  4 27  1  0  0  0
  5 24  1  0  0  0
  5 73  1  0  0  0
  6 25  1  0  0  0
  6 35  1  0  0  0
  7 26  2  0  0  0
  8 27  2  0  0  0
  9 28  2  0  0  0
 10 39  2  0  0  0
 11 44  1  0  0  0
 11 49  1  0  0  0
 12 24  1  0  0  0
 12 27  1  0  0  0
 12 74  1  0  0  0
 13 26  1  0  0  0
 13 31  1  0  0  0
 13 32  1  0  0  0
 14 29  1  0  0  0
 14 38  1  0  0  0
 14 39  1  0  0  0
 15 16  1  0  0  0
 15 18  1  0  0  0
 15 20  1  0  0  0
 16 17  1  0  0  0
 16 75  1  0  0  0
 17 19  1  0  0  0
 17 21  1  0  0  0
 17 76  1  0  0  0
 18 23  1  0  0  0
 18 77  1  0  0  0
 19 22  1  0  0  0
 19 78  1  0  0  0
 20 79  1  0  0  0
 20 80  1  0  0  0
 20 81  1  0  0  0
 21 82  1  0  0  0
 21 83  1  0  0  0
 21 84  1  0  0  0
 22 24  1  0  0  0
 22 85  1  0  0  0
 22 86  1  0  0  0
 23 26  1  0  0  0
 23 87  1  0  0  0
 23 88  1  0  0  0
 24 25  1  0  0  0
 25 30  1  0  0  0
 25 89  1  0  0  0
 28 29  1  0  0  0
 29 33  1  0  0  0
 29 90  1  0  0  0
 30 34  2  0  0  0
 30 91  1  0  0  0
 31 36  1  0  0  0
 31 37  2  0  0  0
 32 92  1  0  0  0
 32 93  1  0  0  0
 32 94  1  0  0  0
 33 95  1  0  0  0
 33 96  1  0  0  0
 33 97  1  0  0  0
 34 40  1  0  0  0
 34 98  1  0  0  0
 35 99  1  0  0  0
 35100  1  0  0  0
 35101  1  0  0  0
 36 41  2  0  0  0
 36102  1  0  0  0
 37 44  1  0  0  0
 38103  1  0  0  0
 38104  1  0  0  0
 38105  1  0  0  0
 39 46  1  0  0  0
 40 43  2  0  0  0
 40106  1  0  0  0
 41 42  1  0  0  0
 41 45  1  0  0  0
 42 43  1  0  0  0
 42107  1  0  0  0
 42108  1  0  0  0
 43 47  1  0  0  0
 44 45  2  0  0  0
 45109  1  0  0  0
 46 48  1  0  0  0
 46110  1  0  0  0
 46111  1  0  0  0
 47112  1  0  0  0
 47113  1  0  0  0
 47114  1  0  0  0
 48 50  1  0  0  0
 48115  1  0  0  0
 48116  1  0  0  0
 49117  1  0  0  0
 49118  1  0  0  0
 49119  1  0  0  0
 50 51  1  0  0  0
 50120  1  0  0  0
 51 52  1  0  0  0
 51 53  2  0  0  0
 52 58  1  0  0  0
 52 54  1  0  0  0
 52121  1  0  0  0
 54 55  1  0  0  0
 54122  1  0  0  0
 54123  1  0  0  0
 55 56  1  0  0  0
 55124  1  0  0  0
 55125  1  0  0  0
 56 57  1  0  0  0
 56 59  1  0  0  0
 56126  1  0  0  0
 57 58  1  0  0  0
 57127  1  0  0  0
 57128  1  0  0  0
 58129  1  0  0  0
 58130  1  0  0  0
 59 60  1  0  0  0
 59131  1  0  0  0
 59132  1  0  0  0
 60 64  1  0  0  0
 60 61  1  0  0  0
 61 62  1  0  0  0
 61 65  2  0  0  0
 62 63  2  0  0  0
 62133  1  0  0  0
 63 64  1  0  0  0
 63 67  1  0  0  0
 64 66  2  0  0  0
 67 68  1  0  0  0
 68 69  1  0  0  0
 68134  1  0  0  0
 68135  1  0  0  0
 69 70  1  0  0  0
 69136  1  0  0  0
 69137  1  0  0  0
 70 71  1  0  0  0
 70 72  2  0  0  0
 71138  1  0  0  0
 71139  1  0  0  0
M  END
> <s_m_entry_id>
87

> <s_m_entry_name>
entry

> <r_f3d_energy>
0

> <i_f3d_flags>
0

$$$$
