ATOM        44
            1   C1a C    18.3876  -22.5931
            2   C1d C    19.6013  -21.8929
            3   C1c C    20.8150  -22.5931
            4   C2b C    22.0288  -21.8929
            5   C2b C    23.2424  -22.5931
            6   C2c C    24.4561  -21.8929
            7   C2b C    25.6698  -22.5931
            8   C2b C    26.8836  -21.8929
            9   C2b C    28.0973  -22.5931
            10  C2c C    29.3110  -21.8929
            11  C2b C    30.5247  -22.5931
            12  C2b C    31.7383  -21.8929
            13  C2b C    32.9521  -22.5931
            14  C2c C    34.1659  -21.8929
            15  C2b C    35.3795  -22.5931
            16  C2b C    36.5933  -21.8929
            17  C2b C    37.8069  -22.5931
            18  C2b C    39.0206  -21.8929
            19  C2c C    40.2343  -22.5931
            20  C2b C    41.4481  -21.8929
            21  C2b C    42.6618  -22.5931
            22  C2b C    43.8755  -21.8929
            23  C2c C    45.0892  -22.5931
            24  C2b C    46.3028  -21.8929
            25  C2b C    47.5166  -22.5931
            26  C2b C    48.7304  -21.8929
            27  C2c C    49.9440  -22.5931
            28  C2b C    51.1111  -21.8929
            29  C2b C    52.3247  -22.5931
            30  C1c C    53.5385  -21.8929
            31  C1d C    54.7522  -22.5931
            32  C1a C    55.9658  -21.8929
            33  O1a O    19.6013  -20.4925
            34  C1a C    24.4561  -20.4925
            35  C1a C    29.3110  -20.4925
            36  C1a C    34.1659  -20.4925
            37  C1a C    40.2343  -23.9935
            38  C1a C    45.0892  -23.9935
            39  C1a C    49.9440  -23.9935
            40  O1a O    54.7522  -23.9935
            41  C1a C    18.3888  -21.1929
            42  C1a C    56.1045  -22.9554
            43  O1a O    20.8153  -24.0098
            44  O1a O    53.5387  -20.5100
BOND        43
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   15  16 1
            16   16  17 2
            17   17  18 1
            18   18  19 2
            19   19  20 1
            20   20  21 2
            21   21  22 1
            22   22  23 2
            23   23  24 1
            24   24  25 2
            25   25  26 1
            26   26  27 2
            27   27  28 1
            28   28  29 2
            29   29  30 1
            30   30  31 1
            31   31  32 1
            32    2  33 1
            33    6  34 1
            34   10  35 1
            35   14  36 1
            36   19  37 1
            37   23  38 1
            38   27  39 1
            39   31  40 1
            40    2  41 1
            41   31  42 1
            42    3  43 1 #Down
            43   30  44 1 #Down