ATOM        28
            1   C8x C    22.1900  -21.2800
            2   C8x C    22.1900  -22.6800
            3   C8x C    23.4024  -23.3800
            4   C8x C    24.6149  -22.6800
            5   C8y C    24.6149  -21.2800
            6   C8x C    23.4024  -20.5800
            7   C1b C    25.8524  -20.5800
            8   C1c C    27.0649  -21.2800
            9   N1c N    28.2773  -20.5800
            10  C5a C    29.4897  -21.2800
            11  C2b C    30.7022  -20.5800
            12  C8y C    27.0649  -22.6800
            13  N5x N    25.9489  -23.4911
            14  C8x C    26.3754  -24.8031
            15  C8x C    27.7550  -24.8029
            16  S2x S    28.1811  -23.4907
            17  C1a C    28.2773  -19.1800
            18  O5a O    29.4897  -22.6799
            19  C2c C    32.1022  -20.5800
            20  C1b C    33.3424  -21.2800
            21  C1c C    34.5549  -20.5800
            22  O2a O    32.4595  -19.2193
            23  C1a C    31.4901  -18.2600
            24  C1d C    35.7860  -21.2910
            25  C1a C    34.5550  -19.1802
            26  X   Cl   36.9984  -21.9910
            27  X   Cl   36.4860  -20.0786
            28  X   Cl   35.0860  -22.5035
BOND        29
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     5   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12    8  12 1 #Down
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   12  16 1
            18    9  17 1
            19   10  18 2
            20   11  19 2
            21   19  20 1
            22   20  21 1
            23   19  22 1
            24   22  23 1
            25   21  24 1
            26   21  25 1 #Down
            27   24  26 1
            28   24  27 1
            29   24  28 1