B8SDR0
-OEChem-04012119272D
50 54 0 0 0 0 0 0 0999 V2000
7.2641 0.9374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.8327 -2.0572 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.8109 -2.2651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 0.4374 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
14.7028 1.2493 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.6418 -0.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7282 -1.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.8497 0.3222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 -0.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8007 0.6313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.3109 -1.3990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 -1.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -0.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 0.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 0.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 1.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 0.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.0086 1.6094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.5439 -0.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 1.9374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 2.4374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 2.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 0.4027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.9597 1.9184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.4949 0.2711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.9582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.9165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.7634 0.9362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2300 0.3439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.9275 -1.3342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3720 -2.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 -1.6826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3991 0.7474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5932 -0.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9962 1.5574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9996 -0.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7966 -0.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.5479 2.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.4150 -0.6443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0690 2.2474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 3.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 3.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -0.2173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.0886 2.5249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.9557 -0.1437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 2.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 0.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 17 1 0 0 0 0
2 3 1 0 0 0 0
2 7 1 0 0 0 0
2 34 1 0 0 0 0
3 11 2 0 0 0 0
4 18 2 0 0 0 0
4 20 1 0 0 0 0
5 27 2 0 0 0 0
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6 7 2 0 0 0 0
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7 9 1 0 0 0 0
8 10 1 0 0 0 0
8 31 1 0 0 0 0
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10 21 2 0 0 0 0
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26 30 1 0 0 0 0
26 46 1 0 0 0 0
27 47 1 0 0 0 0
28 48 1 0 0 0 0
29 30 2 0 0 0 0
29 49 1 0 0 0 0
30 50 1 0 0 0 0
M END
$$$$