BFN8I4
-OEChem-04012115093D
58 62 0 1 0 0 0 0 0999 V2000
2.1861 0.4351 0.7761 S 0 0 0 0 0 0 0 0 0 0 0 0
-7.6554 -3.1352 -0.8708 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5081 2.5802 -2.4102 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5328 1.9347 -0.4648 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6535 2.5422 -0.5350 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4061 1.3127 1.4106 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5983 2.5606 1.0628 C 0 0 2 0 0 0 0 0 0 0 0 0
-3.6641 1.6427 0.5669 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1905 2.1346 0.6282 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6822 0.3096 0.9777 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6465 2.8546 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6780 -0.5681 0.5189 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6389 2.1163 -0.3061 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6692 -0.0866 -0.3691 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1456 -2.3018 0.5879 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6642 1.2222 0.6721 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6357 1.2583 -0.7719 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0192 -1.4702 0.0744 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6331 1.1115 -0.7797 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5621 1.9600 -1.3695 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7116 -1.9130 0.9218 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6650 -0.9642 -0.8279 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9127 0.0852 -0.8879 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7985 0.9073 -1.3955 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9439 -0.1169 0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0412 -2.0457 -0.7369 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5162 -1.8152 0.0802 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1592 -2.3896 2.1258 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6831 -2.2974 -0.4173 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8907 0.6606 -0.0766 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9879 -1.2680 -1.2179 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7083 -2.7709 0.4559 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6151 -4.4853 -0.4108 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7537 3.5428 0.5901 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9211 -0.0578 1.6637 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4689 1.9496 3.1756 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8844 3.5909 2.8624 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6274 3.2512 2.8677 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6401 3.1517 -0.6363 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0245 -3.3296 0.2191 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3876 1.6500 -1.4538 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9591 -2.3039 1.6038 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4348 -0.6097 -1.5112 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9918 1.3665 -2.3626 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6945 0.3519 1.0347 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0846 -3.0982 -1.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7648 -0.8195 0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5309 -1.7675 -1.0144 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3087 -2.5017 0.3975 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3539 -1.4168 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9380 -3.0819 2.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1976 -2.7550 2.5031 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8455 1.7141 0.1888 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2331 -1.7303 -1.8494 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6631 -3.7936 0.8147 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4602 -5.0085 -0.8702 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7539 -4.5453 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7048 -4.9965 -0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
1 19 1 0 0 0 0
2 29 1 0 0 0 0
2 33 1 0 0 0 0
3 20 2 0 0 0 0
4 5 1 0 0 0 0
4 16 1 0 0 0 0
4 20 1 0 0 0 0
5 9 2 0 0 0 0
6 9 1 0 0 0 0
6 16 2 0 0 0 0
7 8 1 0 0 0 0
7 9 1 0 0 0 0
7 11 1 0 0 0 0
7 34 1 0 0 0 0
8 10 2 0 0 0 0
8 13 1 0 0 0 0
10 12 1 0 0 0 0
10 35 1 0 0 0 0
11 36 1 0 0 0 0
11 37 1 0 0 0 0
11 38 1 0 0 0 0
12 14 2 0 0 0 0
12 21 1 0 0 0 0
13 17 2 0 0 0 0
13 39 1 0 0 0 0
14 17 1 0 0 0 0
14 22 1 0 0 0 0
15 18 1 0 0 0 0
15 27 1 0 0 0 0
15 28 1 0 0 0 0
15 40 1 0 0 0 0
17 41 1 0 0 0 0
18 25 2 0 0 0 0
18 26 1 0 0 0 0
19 20 1 0 0 0 0
19 24 2 0 0 0 0
21 32 2 0 0 0 0
21 42 1 0 0 0 0
22 29 2 0 0 0 0
22 43 1 0 0 0 0
23 24 1 0 0 0 0
23 30 2 0 0 0 0
23 31 1 0 0 0 0
24 44 1 0 0 0 0
25 30 1 0 0 0 0
25 45 1 0 0 0 0
26 31 2 0 0 0 0
26 46 1 0 0 0 0
27 47 1 0 0 0 0
27 48 1 0 0 0 0
27 49 1 0 0 0 0
28 50 1 0 0 0 0
28 51 1 0 0 0 0
28 52 1 0 0 0 0
29 32 1 0 0 0 0
30 53 1 0 0 0 0
31 54 1 0 0 0 0
32 55 1 0 0 0 0
33 56 1 0 0 0 0
33 57 1 0 0 0 0
33 58 1 0 0 0 0
M END
$$$$