ENTRY       C00002                      Compound
ATOM        31
            1   N4y N    29.4250  -14.6015
            2   C8y C    30.4825  -15.3378
            3   C1y C    28.1393  -15.0165
            4   C8x C    29.9040  -13.2050
            5   C8y C    31.7155  -14.4321
            6   N5x N    30.6227  -16.7578
            7   O2x O    26.9999  -14.1633
            8   C1y C    27.7071  -16.2669
            9   N5x N    31.3532  -13.2108
            10  C8y C    32.9718  -14.9814
            11  C8x C    31.9434  -17.3478
            12  C1y C    25.8897  -14.9580
            13  C1y C    26.3221  -16.2669
            14  O1a O    28.5133  -17.4063
            15  N5x N    33.1353  -16.4655
            16  N1a N    34.0819  -14.1575
            17  C1b C    24.5691  -14.5315
            18  O1a O    25.8780  -17.5874
            19  O2b O    23.5349  -15.4664
            20  P1b P    22.1325  -15.4664
            21  O2c O    20.7361  -15.4664
            22  O1c O    22.1268  -16.8629
            23  O1c O    22.1268  -14.0698
            24  P1b P    19.3394  -15.4605
            25  O2c O    17.9430  -15.4605
            26  O1c O    19.3337  -16.8571
            27  O1c O    19.3337  -14.0581
            28  P1b P    16.5406  -15.4547
            29  O1c O    16.5348  -16.8512
            30  O1c O    15.1441  -15.4430
            31  O1c O    16.5348  -14.0523
BOND        33
            1     1   2 1
            2     3   1 1 #Up
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 2
            11    7  12 1
            12    8  13 1
            13    8  14 1 #Down
            14   10  15 2
            15   10  16 1
            16   12  17 1 #Up
            17   13  18 1 #Down
            18   17  19 1
            19   19  20 1
            20   20  21 1
            21   20  22 1
            22   20  23 2
            23   21  24 1
            24   24  25 1
            25   24  26 1
            26   24  27 2
            27   25  28 1
            28   28  29 1
            29   28  30 1
            30   28  31 2
            31    5   9 1
            32   11  15 1
            33   12  13 1
///
