Trastuzumab-dTSPEG-MMAF
     RDKit          2D

103105  0  0  1  0  0  0  0  0999 V2000
   13.1129    6.8866    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9689    5.9164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5567    6.4221    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4127    5.4519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0005    5.9575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8565    4.9873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4443    5.4930    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.4491    2.2411    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5931    1.2709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0053    1.7765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.1493    0.8063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.5616    1.3120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -18.7056    0.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3003    4.5228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8881    5.0284    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7441    4.0582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7805    3.6347    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9245    2.6646    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3367    3.1702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4807    2.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8929    2.7056    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0369    1.7354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3319    4.5639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8121    3.5937    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2243    4.0993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3683    3.1291    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -20.1178    0.8474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -21.2618   -0.1228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -22.6740    0.3829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -23.8180   -0.5873    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -25.2302   -0.0817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -26.3742   -1.0519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -27.7864   -0.5462    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -28.9304   -1.5164    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -30.3426   -1.0108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -31.4866   -1.9810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -32.8988   -1.4754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -34.0428   -2.4455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -35.4550   -1.9399    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -36.6941   -2.7852    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -37.8810   -1.8679    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -37.3753   -0.4557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -35.8760   -0.5002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -36.7386   -4.2845    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -34.9587    0.6866    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -39.3207   -2.2889    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  -40.4051   -1.2526    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -38.2206    0.7834    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  -37.5702    2.1350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5251    6.3810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6691    7.3512    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.7933    4.9052    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.4009    8.8270    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.0813    6.8455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3495    5.3697    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2055    4.3995    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.7618    4.8641    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4738    2.9237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3298    1.9535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8860    2.4181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.0300    3.3883    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1542    0.9422    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.9176    2.4592    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.5980    0.4777    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.7736    1.4890    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6493    3.9350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0418    0.0131    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3613    1.9946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0931    3.4704    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2173    1.0244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8051    1.5300    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4540   -0.4925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8978   -0.9571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.4856   -0.4514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7222   -1.9683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1344   -2.4740    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.4685   -2.7918    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.3735   -1.6287    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5604   -2.5460    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0547   -3.9582    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5554   -3.9137    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6381   -5.1005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1516   -4.8995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.2073   -6.4883    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.6938   -6.6893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2344   -6.0864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4175   -3.5915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8035   -7.4742    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.7479   -5.8854    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.8863   -8.6610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4555  -10.0488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.3998   -8.4601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4825   -9.6469    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8306   -7.0722    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.9419  -10.2498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5111  -11.6376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9976  -11.8386    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9149  -10.6518    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3457   -9.2639    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8592   -9.0630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2253    7.8157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9571    9.2916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.6375    7.3101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  1 50  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7 14  1  0
  8  9  1  0
  8 22  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 27  1  0
 14 15  1  0
 15 16  1  0
 16 23  1  0
 17 18  1  0
 17 26  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  1  0
 38 39  1  0
 39 43  1  0
 39 40  1  0
 40 41  1  0
 40 44  2  0
 41 42  1  0
 41 46  1  0
 42 43  1  0
 42 48  1  0
 43 45  2  0
 46 47  1  0
 48 49  1  0
 50 51  1  0
 50 52  2  0
 51 53  1  0
 51 54  1  0
 54 55  1  0
 54101  1  0
 55 56  1  0
 55 57  2  0
 56 58  1  0
 58 59  1  0
 58 60  1  0
 59 63  1  0
 59 64  2  0
 60 61  1  0
 60 62  1  0
 63 65  1  0
 63 66  1  0
 65 67  1  0
 65 68  1  0
 67 72  1  0
 67 73  1  0
 68 69  1  0
 68 70  1  0
 70 71  1  0
 72 75  1  0
 73 74  1  0
 75 76  1  0
 75 77  2  0
 76 81  1  0
 76 78  1  0
 78 79  1  0
 79 80  1  0
 80 81  1  0
 81 82  1  0
 82 83  1  0
 82 84  1  0
 83 86  1  0
 83 87  1  0
 84 85  1  0
 86 88  1  0
 86 89  2  0
 88 90  1  0
 90 91  1  0
 90 92  1  0
 91 95  1  0
 92 93  2  0
 92 94  1  0
 95100  1  0
 95 96  2  0
 96 97  1  0
 97 98  2  0
 98 99  1  0
 99100  2  0
101102  1  0
101103  1  0
M  END
>  <s_m_entry_id>  (1) 
5

>  <s_m_entry_name>  (1) 
entry

>  <r_f3d_energy>  (1) 
0

>  <i_f3d_flags>  (1) 
0

$$$$
