BXF3M0
-OEChem-04022106273D
54 56 0 1 0 0 0 0 0999 V2000
1.2839 -0.1666 0.2366 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0878 0.1991 1.4822 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3802 -0.6829 -1.8261 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.0007 -0.6950 -0.7627 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.2496 0.8132 1.5579 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6489 1.8256 -0.1175 N 0 0 0 0 0 0 0 0 0 0 0 0
3.1116 4.6402 -0.5065 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2321 3.5642 -1.1417 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7735 4.1215 0.7691 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0111 2.2696 -1.3634 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5239 2.8178 0.5108 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5109 0.5610 0.4535 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5898 -0.4020 -0.2521 C 0 0 1 0 0 0 0 0 0 0 0 0
3.0069 -1.8237 -0.0041 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4913 -2.5214 1.0882 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9094 -2.4462 -0.8664 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2650 -0.3441 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8785 -3.8415 1.3185 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2964 -3.7665 -0.6362 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7811 -4.4641 0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0132 -0.0528 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1660 -0.1566 -0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4991 0.0960 -0.0727 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6357 -0.4231 -0.6925 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6243 0.8544 1.0913 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8977 -0.1843 -0.1481 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8862 1.0934 1.6355 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0229 0.5741 1.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7870 -1.4591 -1.9481 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5094 5.5267 -0.2793 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8848 4.9494 -1.2205 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3763 3.3653 -0.4842 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8319 3.9268 -2.0949 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0019 3.9524 1.5305 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4616 4.8760 1.1656 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3214 1.5433 -1.7866 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8106 2.4254 -2.0974 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3663 2.9882 -0.1701 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9349 2.4362 1.4508 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6540 -0.2635 -1.3341 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7956 -2.0569 1.7815 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3212 -1.9140 -1.7198 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4794 -4.3840 2.1705 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9999 -4.2511 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0833 -5.4918 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9573 0.2172 1.0769 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1602 -0.4566 -1.6929 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4820 -1.0071 -1.5942 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7700 1.2951 1.5965 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9704 1.6893 2.5404 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1419 1.3535 2.3593 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3493 -0.8512 -2.7472 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2059 -2.3652 -1.7455 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7705 -1.7862 -2.3015 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
1 17 1 0 0 0 0
2 12 2 0 0 0 0
3 17 2 0 0 0 0
4 26 1 0 0 0 0
4 29 1 0 0 0 0
5 28 1 0 0 0 0
5 51 1 0 0 0 0
6 10 1 0 0 0 0
6 11 1 0 0 0 0
6 12 1 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 30 1 0 0 0 0
7 31 1 0 0 0 0
8 10 1 0 0 0 0
8 32 1 0 0 0 0
8 33 1 0 0 0 0
9 11 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
11 38 1 0 0 0 0
11 39 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
13 40 1 0 0 0 0
14 15 2 0 0 0 0
14 16 1 0 0 0 0
15 18 1 0 0 0 0
15 41 1 0 0 0 0
16 19 2 0 0 0 0
16 42 1 0 0 0 0
17 21 1 0 0 0 0
18 20 2 0 0 0 0
18 43 1 0 0 0 0
19 20 1 0 0 0 0
19 44 1 0 0 0 0
20 45 1 0 0 0 0
21 22 2 0 0 0 0
21 46 1 0 0 0 0
22 23 1 0 0 0 0
22 47 1 0 0 0 0
23 24 2 0 0 0 0
23 25 1 0 0 0 0
24 26 1 0 0 0 0
24 48 1 0 0 0 0
25 27 2 0 0 0 0
25 49 1 0 0 0 0
26 28 2 0 0 0 0
27 28 1 0 0 0 0
27 50 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
M END
$$$$