BC20IJ
-OEChem-04042105343D
32 33 0 0 0 0 0 0 0999 V2000
3.2598 -0.7732 -0.6097 S 0 0 0 0 0 0 0 0 0 0 0 0
1.4976 -2.6065 -0.0820 F 0 0 0 0 0 0 0 0 0 0 0 0
3.2603 -2.6186 1.2020 F 0 0 0 0 0 0 0 0 0 0 0 0
1.7328 -1.0881 1.4708 F 0 0 0 0 0 0 0 0 0 0 0 0
3.7992 -1.6453 -1.6362 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1318 0.1007 0.1495 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.1630 -0.8012 -0.1431 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9419 0.1028 -1.2835 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6561 -0.0307 -0.0646 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3929 3.3683 0.9052 N 0 0 0 0 0 0 0 0 0 0 0 0
1.4036 1.1999 -0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1447 1.1226 0.0449 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0529 -0.2256 -0.0833 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1576 2.3602 -0.4041 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3108 2.2244 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4003 -1.8083 0.5376 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5985 -1.4107 0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8885 0.7662 -0.5967 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6120 3.4066 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9796 -1.6041 0.3904 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2698 0.5728 -0.6168 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8153 -0.6123 -0.1233 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2317 -0.4673 -1.7619 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1244 -0.8931 -0.1358 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1378 2.4644 -0.8569 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2723 2.2317 1.2545 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9572 -2.1905 0.8134 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4899 1.6895 -1.0079 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1582 4.3346 0.4551 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3988 -2.5293 0.7764 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9098 1.3510 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5855 -0.0159 -0.5315 H 0 0 0 0 0 0 0 0 0 0 0 0
1 5 2 0 0 0 0
1 6 2 0 0 0 0
1 8 1 0 0 0 0
1 16 1 0 0 0 0
2 16 1 0 0 0 0
3 16 1 0 0 0 0
4 16 1 0 0 0 0
7 22 1 0 0 0 0
7 32 1 0 0 0 0
8 11 1 0 0 0 0
8 23 1 0 0 0 0
9 12 1 0 0 0 0
9 13 1 0 0 0 0
9 24 1 0 0 0 0
10 15 2 0 0 0 0
10 19 1 0 0 0 0
11 12 2 0 0 0 0
11 14 1 0 0 0 0
12 15 1 0 0 0 0
13 17 2 0 0 0 0
13 18 1 0 0 0 0
14 19 2 0 0 0 0
14 25 1 0 0 0 0
15 26 1 0 0 0 0
17 20 1 0 0 0 0
17 27 1 0 0 0 0
18 21 2 0 0 0 0
18 28 1 0 0 0 0
19 29 1 0 0 0 0
20 22 2 0 0 0 0
20 30 1 0 0 0 0
21 22 1 0 0 0 0
21 31 1 0 0 0 0
M END
$$$$