BME6S3
-OEChem-04022102362D
48 52 0 1 0 0 0 0 0999 V2000
2.0000 3.1082 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
14.5414 -3.1187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
16.2735 -2.1187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
11.0773 -0.1187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1282 1.5840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.9434 -1.6187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.8094 -0.1187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5301 1.0840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
15.4075 -1.6187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.4947 0.2177 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
9.9947 1.0838 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.9942 1.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1638 -0.5254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.9728 0.8758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9434 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2622 1.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3961 1.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3961 2.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8094 -2.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.6754 -0.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.6754 -1.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5301 3.0840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6641 1.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6641 2.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.5414 -2.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7702 1.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7702 3.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8641 1.5632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8641 2.6048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8071 -0.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0836 1.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5559 0.6456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6622 -0.8898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4738 -1.0623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.5928 0.8758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0376 1.4924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1282 2.2040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8636 0.6091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6607 0.6091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9331 2.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.8094 -2.7387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2124 -0.3087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5301 3.7040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7773 0.4294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7773 3.7386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3284 1.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.4075 -0.9987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.8104 -1.8087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 29 1 0 0 0 0
2 25 2 0 0 0 0
3 9 1 0 0 0 0
3 48 1 0 0 0 0
4 13 1 0 0 0 0
4 14 1 0 0 0 0
4 15 1 0 0 0 0
5 12 1 0 0 0 0
5 16 1 0 0 0 0
5 37 1 0 0 0 0
6 15 2 0 0 0 0
6 19 1 0 0 0 0
7 15 1 0 0 0 0
7 20 2 0 0 0 0
8 17 2 0 0 0 0
8 23 1 0 0 0 0
9 25 1 0 0 0 0
9 47 1 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 13 1 0 0 0 0
10 30 1 6 0 0 0
11 12 1 0 0 0 0
11 14 1 0 0 0 0
11 31 1 6 0 0 0
12 32 1 0 0 0 0
13 33 1 0 0 0 0
13 34 1 0 0 0 0
14 35 1 0 0 0 0
14 36 1 0 0 0 0
16 17 1 0 0 0 0
16 38 1 0 0 0 0
16 39 1 0 0 0 0
17 18 1 0 0 0 0
18 22 2 0 0 0 0
18 40 1 0 0 0 0
19 21 2 0 0 0 0
19 41 1 0 0 0 0
20 21 1 0 0 0 0
20 42 1 0 0 0 0
21 25 1 0 0 0 0
22 24 1 0 0 0 0
22 43 1 0 0 0 0
23 24 2 0 0 0 0
23 26 1 0 0 0 0
24 27 1 0 0 0 0
26 28 2 0 0 0 0
26 44 1 0 0 0 0
27 29 2 0 0 0 0
27 45 1 0 0 0 0
28 29 1 0 0 0 0
28 46 1 0 0 0 0
M END
$$$$