PDC_02136.sdf
  ChemDraw08282420162D

127135  0  0  1  0  0  0  0  0999 V2000
   -3.0299   -6.8409    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2173   -1.5599    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3563   -3.0768    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7488   -3.3346    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4017   -2.5904    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9138   -4.1503    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5668   -3.4061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0378   -2.7335    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8558   -2.8051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2787   -3.5089    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3945   -2.1853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1503   -2.5062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2944   -1.3703    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9502   -0.8761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7060   -1.1970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8061   -2.0120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0788   -3.3242    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6985   -3.8629    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4598   -3.9356    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9888   -4.6083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3358   -5.3525    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2778   -4.0072    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6998   -5.2093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1182   -5.1378    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7409   -7.4419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4652   -4.3936    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1708   -4.5367    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2119   -6.7693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8648   -6.0251    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0468   -5.9535    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7542   -4.9946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4072   -5.7388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8782   -6.4115    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5892   -5.8104    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5312   -7.1557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5722   -4.9231    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0432   -5.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8612   -5.5241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6962   -6.3399    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3322   -6.1968    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0843   -3.3631    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2083   -4.7799    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9023   -3.2915    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7373   -4.1073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0353   -1.4883    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5063   -2.1610    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6303   -3.5778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1593   -2.9052    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3243   -2.0894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7953   -2.7620    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4483   -3.5062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9193   -4.1789    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4894   -1.2736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9603   -1.9463    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6714   -1.3452    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6133   -2.6905    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0674   -2.4758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4144   -1.7316    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5383   -3.1484    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2493   -2.5473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7784   -1.8747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7124    0.8874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3654    0.1432    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0306    1.2738    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8364   -0.5294    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2415    1.5600    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7874    1.3453    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2584    0.6727    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0764    0.7443    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5474    0.0716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8775    1.7032    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5304    0.9590    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6955    1.7747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0425    2.5189    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4065    2.3758    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7535    3.1200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5715    3.1916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9185    3.9358    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4476    4.6084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6296    4.5368    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2825    3.7926    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4965    2.7336    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9845    1.1737    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4555    0.5010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1084   -0.2432    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1665    1.1021    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1495    1.9894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6205    1.3168    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3315    1.9179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1127   -3.1914    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2947   -3.1199    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9477   -2.3757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1297   -2.3041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2735    0.5726    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1545    2.6906    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5016    1.9464    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6086    2.4759    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7906    2.5475    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3196    1.8748    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6205    7.4419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1982    7.4419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9094    7.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9094    6.2102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1982    5.7997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4871    6.2102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4871    7.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7760    7.4419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9315    7.4419    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3538    5.7997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6426    6.2102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6426    7.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3538    7.4419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0649    7.0314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0649    6.2102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7760    5.7997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5140    5.4397    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9904    4.0561    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3997    4.6265    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7325    3.8928    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0796    3.1486    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9002    3.1199    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3353    3.8163    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1560    3.7876    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5911    4.4840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2056    5.2090    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3850    5.2376    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9498    4.5413    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  4 22  1  0        0
 17 18  1  0        0
 20 27  1  0        0
 24 34  1  0        0
 33 39  1  0        0
 38 42  1  0        0
 41 56  1  0        0
 53 65  1  0        0
 62 72  1  0        0
 73 86  1  0        0
  5  4  2  0        0
  4  7  1  0        0
  7  6  1  1        0
  7  8  1  0        0
  8  9  1  0        0
 10  9  2  0        0
 11  9  1  0        0
 17 10  1  0        0
 11 12  2  0        0
 11 13  1  0        0
 12 17  1  0        0
 16 12  1  0        0
 13 14  2  0        0
 14 15  1  0        0
 15 16  2  0        0
 22 19  1  0        0
 19 20  1  0        0
 20 21  2  0        0
 28 25  2  0        0
 29 28  1  0        0
 30 29  1  0        0
 24 23  1  0        0
 23 27  1  0        0
 23 30  1  6        0
 24 26  2  0        0
 28  1  1  0        0
 32 31  1  1        0
 34 32  1  0        0
 32 33  1  0        0
 33 35  2  0        0
 37 36  1  1        0
 39 37  1  0        0
 37 38  1  0        0
 38 40  2  0        0
 46 45  1  0        0
 48 47  2  0        0
 46 48  1  0        0
 49 46  2  0        0
 50 49  1  0        0
 50 51  2  0        0
 47 51  1  0        0
 52 51  1  0        0
 43 41  2  0        0
 41 44  1  0        0
 44 42  1  0        0
 44 52  1  1        0
 45  2  1  0        0
 57 58  2  0        0
 57 59  1  0        0
 60 57  1  0        0
 61 60  1  0        0
 55 53  2  0        0
 53 54  1  0        0
 54 56  1  0        0
 54 61  1  6        0
 59  3  1  0        0
 67 64  1  0        0
 68 67  1  0        0
 69 68  1  0        0
 70 69  1  0        0
 66 62  2  0        0
 62 63  1  0        0
 63 65  1  0        0
 63 70  1  6        0
 76 75  1  0        0
 77 76  1  0        0
 78 77  2  0        0
 79 78  1  0        0
 80 79  2  0        0
 81 76  2  0        0
 81 80  1  0        0
 71 75  1  1        0
 71 72  1  0        0
 71 73  1  0        0
 73 74  2  0        0
 87 82  1  0        0
 87 88  1  0        0
 87 89  1  0        0
 83 89  1  1        0
 83 86  1  0        0
 83 84  1  0        0
 84 85  2  0        0
 19 90  1  6        0
 90 91  1  0        0
 91 92  1  0        0
 92 93  1  0        0
 84 94  1  0        0
 96 95  2  0        0
 99 96  1  0        0
 98 97  1  0        0
 99 98  1  0        0
102100  1  0        0
106101  1  0        0
102101  2  0        0
103102  1  0        0
104103  2  0        0
105104  1  0        0
115105  1  0        0
106105  2  0        0
107106  1  0        0
113107  1  0        0
111108  1  0        0
114109  1  0        0
110109  2  0        0
111110  1  0        0
112111  2  0        0
113112  1  0        0
114113  2  0        0
115114  1  0        0
125115  1  0        0
116115  1  0        0
118116  1  0        0
118117  2  0        0
124118  1  0        0
120119  2  0        0
121120  1  0        0
122121  1  0        0
127122  1  0        0
123122  2  0        0
124123  1  0        0
125124  2  0        0
126125  1  0        0
127126  2  0        0
120 97  1  0        0
 96 64  1  0        0
M  END
$$$$
