BPK17F
-OEChem-04022103033D
58 61 0 1 0 0 0 0 0999 V2000
1.7005 3.2596 -0.5796 N 0 0 0 0 0 0 0 0 0 0 0 0
2.1829 -1.7861 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6252 1.7923 0.2811 N 0 0 2 0 0 0 0 0 0 0 0 0
0.5751 -4.1290 -0.3322 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.8837 -0.6315 0.2072 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7586 2.3488 0.0812 C 0 0 2 0 0 0 0 0 0 0 0 0
1.1374 0.8944 -0.2419 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6055 0.6165 -0.0355 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5250 1.6781 0.0285 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6624 2.6511 -0.3905 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0661 -0.7047 0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0477 3.1082 -0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0768 -2.7376 1.0523 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8953 -2.3302 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7567 -3.5044 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5811 -3.1101 -1.3807 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8881 1.4014 0.1994 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4262 -0.9690 0.1944 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3359 0.0827 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8586 1.6832 -0.5023 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9233 2.2973 1.6238 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6282 0.4338 -0.1652 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0113 0.4231 -0.2467 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6731 -0.7568 0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7892 1.6235 -0.6625 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5618 -1.7607 0.5121 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9419 -1.8741 0.4623 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8327 2.5160 1.1635 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8933 0.6636 -1.2871 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5496 0.2265 0.3996 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6891 2.4853 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9097 3.7120 -0.2455 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0758 3.5234 0.9959 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7341 3.6970 -0.6384 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3961 4.2251 -0.4576 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1213 -2.2075 2.0116 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9191 -3.4402 1.0211 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7203 -2.9838 -1.7042 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8194 -1.5248 -2.1334 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7465 -4.2808 1.7496 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0834 -2.8305 1.1882 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4410 -3.5951 -2.3527 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2637 -2.4239 -1.2393 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6079 2.2128 0.2711 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7972 -1.9894 0.2468 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3171 -4.6224 -0.3483 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3947 -0.1238 0.4054 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6302 1.5918 -1.5728 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4521 2.5969 -0.3862 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0310 2.3032 2.2573 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6440 1.6509 2.1374 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3361 3.3129 1.6051 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7568 -0.8212 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7220 2.4083 0.0979 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4315 2.0090 -1.6229 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8513 1.3875 -0.7935 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9451 -2.6031 0.8077 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4363 -2.8044 0.7174 H 0 0 0 0 0 0 0 0 0 0 0 0
1 6 1 0 0 0 0
1 12 1 0 0 0 0
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2 11 1 0 0 0 0
2 13 1 0 0 0 0
2 14 1 0 0 0 0
3 10 1 0 0 0 0
3 20 1 0 0 0 0
3 21 1 0 0 0 0
4 15 1 0 0 0 0
4 16 1 0 0 0 0
4 46 1 0 0 0 0
5 22 1 0 0 0 0
5 26 2 0 0 0 0
6 7 1 0 0 0 0
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6 28 1 0 0 0 0
7 8 1 0 0 0 0
7 29 1 0 0 0 0
7 30 1 0 0 0 0
8 9 2 0 0 0 0
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9 12 1 0 0 0 0
9 17 1 0 0 0 0
10 31 1 0 0 0 0
10 32 1 0 0 0 0
11 18 2 0 0 0 0
12 33 1 0 0 0 0
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14 16 1 0 0 0 0
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15 40 1 0 0 0 0
15 41 1 0 0 0 0
16 42 1 0 0 0 0
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17 19 2 0 0 0 0
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20 22 1 0 0 0 0
20 48 1 0 0 0 0
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22 23 2 0 0 0 0
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25 56 1 0 0 0 0
26 27 1 0 0 0 0
26 57 1 0 0 0 0
27 58 1 0 0 0 0
M END
$$$$