ALIGN       6
            1     1:C1c  30:C1c #M1
            2     2:C6a  32:C6a
            3     3:C1a  33:C1a
            4     4:N1a  27:N1b #R1
            5     5:O6a  37:O6a
            6     6:O6a  36:O6a
            -       *    22:C5a #D1
ENTRY1      
 COMPOUND  C00041
 ATOM      6
            1   C1c C    21.7838  -17.8048
            2   C6a C    20.6419  -17.0552
            3   C1a C    23.0137  -17.1196
            4   N1a N    21.8249  -19.2102
            5   O6a O    19.4123  -17.7404
            6   O6a O    20.5834  -15.6440
 BOND      5
            1     1   2 1
            2     1   3 1
            3     1   4 1 #Down
            4     2   5 1
            5     2   6 2
ENTRY2      
 COMPOUND  C01212
 ATOM      49
            1   C1y C    -1.7621    0.9414
            2   C1y C    -1.7621    0.1310
            3   O2x O    -2.4655    1.3414
            4   O2b O    -1.0655    1.3414
            5   C1y C    -2.4655   -0.2759
            6   N1b N    -0.9724   -0.5966
            7   C1y C    -3.1586    0.9414
            8   P1b P    -0.2621    1.3414
            9   C1y C    -3.1586    0.1310
            10  O2a O    -2.4655   -1.0828
            11  C5a C    -0.9724   -1.4034
            12  C1b C    -3.8517    1.3414
            13  O2c O     0.5379    1.3414
            14  O1c O    -0.2621    2.1448
            15  O1c O    -0.2621    0.5414
            16  O1a O    -3.8552   -0.2655
            17  C1c C    -3.1621   -1.4793
            18  C1a C    -0.2759   -1.8000
            19  O5a O    -1.6655   -1.8035
            20  O1a O    -3.8586    2.1690
            21  P1b P     1.3379    1.3414
            22  C5a C    -3.1655   -2.2828
            23  C1a C    -3.8552   -1.0793
            24  O2b O     2.1448    1.3414
            25  O1c O     1.3414    2.1448
            26  O1c O     1.3379    0.5414
            27  N1b N    -4.0483   -2.9655
            28  O5a O    -2.4724   -2.6828
            29  C1b C     2.3172    0.5552
            30  C1c C    -4.0586   -3.7586
            31  C1y C     3.0793    0.3103
            32  C6a C    -4.8276   -4.0207
            33  C1a C    -3.3828   -4.2138
            34  O2x O     3.7172    0.7793
            35  C1y C     3.3379   -0.4517
            36  O6a O    -5.4862   -3.5552
            37  O6a O    -4.8276   -4.8241
            38  C1y C     4.3759    0.2966
            39  C1y C     4.1345   -0.4517
            40  O1a O     2.8690   -1.1035
            41  N4y N     5.0034    1.6035
            42  O1a O     4.6138   -1.1000
            43  C8y C     4.3103    2.0138
            44  C8x C     5.7069    2.0138
            45  N4x N     4.3103    2.8276
            46  O5x O     3.6138    1.6172
            47  C8x C     5.7069    2.8276
            48  C8y C     5.0069    3.2276
            49  O5x O     5.0034    4.0241
 BOND      51
            1     1   2 1
            2     1   3 1
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Down
            6     3   7 1
            7     4   8 1
            8     5   9 1
            9     5  10 1 #Up
            10    6  11 1
            11    7  12 1 #Up
            12    8  13 1
            13    8  14 1
            14    8  15 2
            15    9  16 1 #Down
            16   10  17 1
            17   11  18 1
            18   11  19 2
            19   12  20 1
            20   13  21 1
            21   17  22 1
            22   17  23 1
            23   21  24 1
            24   21  25 1
            25   21  26 2
            26   22  27 1
            27   22  28 2
            28   24  29 1
            29   27  30 1
            30   31  29 1 #Up
            31   30  32 1
            32   30  33 1
            33   31  34 1
            34   31  35 1
            35   32  36 1
            36   32  37 2
            37   34  38 1
            38   35  39 1
            39   35  40 1 #Down
            40   38  41 1 #Up
            41   39  42 1 #Down
            42   41  43 1
            43   41  44 1
            44   43  45 1
            45   43  46 2
            46   44  47 2
            47   45  48 1
            48   48  49 2
            49    7   9 1
            50   38  39 1
            51   47  48 1