ATOM        65
            1   C1y C    -0.9345    3.0448
            2   C1y C    -0.2862    2.6621
            3   O2a O    -2.0552    2.3000
            4   C1y C    -0.9345    3.8034
            5   C1y C     0.3724    3.0448
            6   O2a O    -0.2862    1.9103
            7   C1y C    -3.3690    1.9241
            8   O2x O    -0.2862    4.1793
            9   C1b C    -1.5828    4.1793
            10  C1y C     0.3724    3.8034
            11  N1b N     1.0345    2.8345
            12  C1c C    -0.9379    1.5379
            13  C1y C    -3.3690    1.1655
            14  O2x O    -4.0276    2.3000
            15  O1a O    -1.5828    4.9276
            16  O1a O     1.0207    4.1793
            17  C5a C     1.0345    2.0241
            18  C5a C    -0.9379    0.8517
            19  C1a C    -1.5724    1.7276
            20  C1y C    -4.0276    0.7828
            21  N1b N    -2.7483    0.7069
            22  C1y C    -4.6759    1.9241
            23  C1a C     1.7000    1.6724
            24  O5a O     0.4000    1.6690
            25  N1b N    -0.3448    0.4069
            26  O5a O    -1.6069    0.3966
            27  C1y C    -4.6759    1.1655
            28  O1a O    -4.0276    0.0310
            29  C5a C    -2.7483   -0.0690
            30  C1b C    -5.3241    2.3000
            31  C1c C    -0.3414   -0.3690
            32  O1a O    -5.3276    0.7931
            33  C1a C    -3.3138   -0.4931
            34  O5a O    -2.0655   -0.3793
            35  O1a O    -5.3241    3.0483
            36  C5a C     0.3793   -0.6138
            37  C1a C    -0.9724   -0.7931
            38  N1b N     0.7655    0.1931
            39  O5a O     0.3793   -1.3621
            40  C1c C     1.7931   -0.1000
            41  C1b C     2.2276   -0.7069
            42  C6a C     2.0241    0.6034
            43  C1b C     1.9931   -1.4138
            44  O6a O     2.7621    0.6207
            45  O6a O     1.5759    1.2034
            46  C5a C     2.5862   -1.8690
            47  N1b N     2.3552   -2.6241
            48  O5a O     3.2862   -1.5931
            49  C1c C     2.4483   -3.3793
            50  C1b C     1.8345   -3.8034
            51  C5a C     3.1552   -3.6276
            52  C1b C     1.1276   -3.5448
            53  N1b N     3.7690   -3.1931
            54  O5a O     3.1552   -4.3655
            55  C1b C     0.6483   -4.1241
            56  C1c C     4.8966   -2.7103
            57  C1c C    -0.0414   -3.8724
            58  C6a C     5.5069   -3.1655
            59  C1a C     4.9103   -1.9207
            60  C6a C    -0.2379   -3.1483
            61  N1a N    -0.5207   -4.4414
            62  O6a O     5.5138   -3.9000
            63  O6a O     6.1241   -2.7414
            64  O6a O     0.2931   -2.6207
            65  O6a O    -0.9621   -2.9586
BOND        66
            1     1   2 1
            2     1   3 1 #Down
            3     1   4 1
            4     2   5 1
            5     2   6 1 #Up
            6     7   3 1 #Up
            7     4   8 1
            8     4   9 1 #Up
            9     5  10 1
            10    5  11 1 #Down
            11    6  12 1
            12    7  13 1
            13    7  14 1
            14    9  15 1
            15   10  16 1 #Down
            16   11  17 1
            17   12  18 1
            18   12  19 1
            19   13  20 1
            20   13  21 1 #Down
            21   14  22 1
            22   17  23 1
            23   17  24 2
            24   18  25 1
            25   18  26 2
            26   20  27 1
            27   20  28 1 #Up
            28   21  29 1
            29   22  30 1 #Up
            30   31  25 1 #Down
            31   27  32 1 #Down
            32   29  33 1
            33   29  34 2
            34   30  35 1
            35   31  36 1
            36   31  37 1
            37   36  38 1
            38   36  39 2
            39   40  38 1 #Up
            40   40  41 1
            41   40  42 1
            42   41  43 1
            43   42  44 1
            44   42  45 2
            45   43  46 1
            46   46  47 1
            47   46  48 2
            48   49  47 1 #Down
            49   49  50 1
            50   49  51 1
            51   50  52 1
            52   51  53 1
            53   51  54 2
            54   52  55 1
            55   56  53 1 #Down
            56   55  57 1
            57   56  58 1
            58   56  59 1
            59   57  60 1
            60   57  61 1
            61   58  62 1
            62   58  63 2
            63   60  64 1
            64   60  65 2
            65    8  10 1
            66   22  27 1