BD25RC
-OEChem-04012119352D
56 59 0 0 0 0 0 0 0999 V2000
4.8511 0.2958 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.6602 -4.2920 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
10.2734 -0.9402 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.6602 -4.2920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.6602 -4.2920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1602 1.2469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8090 4.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3968 3.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2212 5.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 5.0707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.8952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9901 2.7604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3913 3.7785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5724 2.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5778 1.9514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9791 2.9694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1602 1.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6602 -0.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4692 0.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6602 -1.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4202 -0.0132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6602 -3.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5262 -1.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7941 -1.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5262 -2.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7941 -2.7920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1634 0.6559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6281 -0.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6602 -5.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1144 0.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5792 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3223 -0.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7228 5.6564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8568 5.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7196 4.9275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9825 4.5691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1196 5.4352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2536 5.5723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6356 4.3968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4984 3.5307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3644 3.3936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3735 2.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6435 4.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3257 1.3850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5957 3.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0631 -1.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2572 -1.4820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0631 -3.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2572 -3.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0345 1.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1674 -1.4062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0402 -5.2920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6602 -5.9120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2802 -5.2920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5752 0.7618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7081 -1.9068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 1 0 0 0 0
1 18 1 0 0 0 0
2 4 2 0 0 0 0
2 5 2 0 0 0 0
2 22 1 0 0 0 0
2 29 1 0 0 0 0
3 32 1 0 0 0 0
6 17 2 0 0 0 0
6 19 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 10 1 0 0 0 0
7 11 1 0 0 0 0
8 12 2 0 0 0 0
8 13 1 0 0 0 0
9 33 1 0 0 0 0
9 34 1 0 0 0 0
9 35 1 0 0 0 0
10 36 1 0 0 0 0
10 37 1 0 0 0 0
10 38 1 0 0 0 0
11 39 1 0 0 0 0
11 40 1 0 0 0 0
11 41 1 0 0 0 0
12 15 1 0 0 0 0
12 42 1 0 0 0 0
13 16 2 0 0 0 0
13 43 1 0 0 0 0
14 15 2 0 0 0 0
14 16 1 0 0 0 0
14 17 1 0 0 0 0
15 44 1 0 0 0 0
16 45 1 0 0 0 0
18 19 2 0 0 0 0
18 20 1 0 0 0 0
19 21 1 0 0 0 0
20 23 2 0 0 0 0
20 24 1 0 0 0 0
21 27 2 0 0 0 0
21 28 1 0 0 0 0
22 25 2 0 0 0 0
22 26 1 0 0 0 0
23 25 1 0 0 0 0
23 46 1 0 0 0 0
24 26 2 0 0 0 0
24 47 1 0 0 0 0
25 48 1 0 0 0 0
26 49 1 0 0 0 0
27 30 1 0 0 0 0
27 50 1 0 0 0 0
28 31 2 0 0 0 0
28 51 1 0 0 0 0
29 52 1 0 0 0 0
29 53 1 0 0 0 0
29 54 1 0 0 0 0
30 32 2 0 0 0 0
30 55 1 0 0 0 0
31 32 1 0 0 0 0
31 56 1 0 0 0 0
M END
$$$$