File: mask.mol2.1.save

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@<TRIPOS>MOLECULE
Cpptraj Generated mol2 file.
   30    30    10     0     0
SMALL
USER_CHARGES


@<TRIPOS>ATOM
      1 O          14.3822   17.1122   13.1338 OW         1 WAT     -0.834000
      2 H1         14.2079   16.9639   14.0633 HW         1 WAT      0.417000
      3 H2         15.1789   17.6427   13.1213 HW         1 WAT      0.417000
      4 O          21.4610   15.7159   16.3128 OW         2 WAT     -0.834000
      5 H1         20.6360   15.6685   16.7960 HW         2 WAT      0.417000
      6 H2         21.2394   16.1805   15.5057 HW         2 WAT      0.417000
      7 O          19.8630   20.4358   12.6372 OW         3 WAT     -0.834000
      8 H1         19.4939   19.6794   13.0930 HW         3 WAT      0.417000
      9 H2         20.2138   20.9886   13.3355 HW         3 WAT      0.417000
     10 O          16.1764   16.0935   11.5026 OW         4 WAT     -0.834000
     11 H1         15.4753   16.3949   12.0804 HW         4 WAT      0.417000
     12 H2         15.7334   15.8741   10.6829 HW         4 WAT      0.417000
     13 O          17.7766   18.3301   10.1433 OW         5 WAT     -0.834000
     14 H1         16.9477   17.9691   10.4575 HW         5 WAT      0.417000
     15 H2         18.4335   17.9815   10.7461 HW         5 WAT      0.417000
     16 O          20.9634   17.3254   13.9742 OW         6 WAT     -0.834000
     17 H1         20.0941   17.7261   13.9763 HW         6 WAT      0.417000
     18 H2         21.3873   17.6769   13.1913 HW         6 WAT      0.417000
     19 O          14.4387   19.7520   15.4388 OW         7 WAT     -0.834000
     20 H1         13.7357   19.1025   15.4520 HW         7 WAT      0.417000
     21 H2         15.1569   19.3183   14.9779 HW         7 WAT      0.417000
     22 O          12.8753   15.3731   17.6226 OW         8 WAT     -0.834000
     23 H1         13.4735   15.9358   18.1143 HW         8 WAT      0.417000
     24 H2         12.0641   15.8780   17.5654 HW         8 WAT      0.417000
     25 O          22.8328   13.8156   17.6101 OW         9 WAT     -0.834000
     26 H1         23.2364   13.2674   16.9371 HW         9 WAT      0.417000
     27 H2         22.1015   14.2429   17.1641 HW         9 WAT      0.417000
     28 O          14.5707   13.4193   16.9778 OW        10 WAT     -0.834000
     29 H1         14.5113   12.7413   17.6509 HW        10 WAT      0.417000
     30 H2         13.9448   14.0881   17.2556 HW        10 WAT      0.417000
@<TRIPOS>BOND
    1     2     1 1
    2     3     1 1
    3     3     2 1
    4     5     4 1
    5     6     4 1
    6     6     5 1
    7     8     7 1
    8     9     7 1
    9     9     8 1
   10    11    10 1
   11    12    10 1
   12    12    11 1
   13    14    13 1
   14    15    13 1
   15    15    14 1
   16    17    16 1
   17    18    16 1
   18    18    17 1
   19    20    19 1
   20    21    19 1
   21    21    20 1
   22    23    22 1
   23    24    22 1
   24    24    23 1
   25    26    25 1
   26    27    25 1
   27    27    26 1
   28    29    28 1
   29    30    28 1
   30    30    29 1
@<TRIPOS>SUBSTRUCTURE
      1 WAT               1 ****               0 ****  **** 
      2 WAT               4 ****               0 ****  **** 
      3 WAT               7 ****               0 ****  **** 
      4 WAT              10 ****               0 ****  **** 
      5 WAT              13 ****               0 ****  **** 
      6 WAT              16 ****               0 ****  **** 
      7 WAT              19 ****               0 ****  **** 
      8 WAT              22 ****               0 ****  **** 
      9 WAT              25 ****               0 ****  **** 
     10 WAT              28 ****               0 ****  ****