B2PEI5
-OEChem-04012117472D
50 54 0 0 0 0 0 0 0999 V2000
6.6353 1.0757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.9462 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.1415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.3585 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.8585 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -1.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4026 -2.7068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9405 -2.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9917 -3.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9422 -3.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.6415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 -0.1415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.3585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 0.6632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 1.6138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.8585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9674 1.8200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.6415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3211 2.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 2.7705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6318 3.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 3.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6138 1.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2816 0.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9244 2.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2601 0.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9030 2.4386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5708 1.6943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4266 -1.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9411 -2.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9425 -3.1224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5572 -2.2679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0684 -1.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4553 -3.8257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2449 -4.0808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0722 -3.8104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5587 -3.1383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8819 -0.1415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.9515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7144 2.2302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 2.1685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.1685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8848 2.8983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2177 3.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8029 4.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0890 -0.0517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5104 2.6939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6742 0.2823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0956 3.0280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1775 1.8222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 1 0 0 0 0
1 23 1 0 0 0 0
2 6 1 0 0 0 0
2 11 1 0 0 0 0
2 12 1 0 0 0 0
3 11 2 0 0 0 0
3 18 1 0 0 0 0
4 16 1 0 0 0 0
4 18 2 0 0 0 0
5 16 1 0 0 0 0
5 41 1 0 0 0 0
5 42 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 29 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 10 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 13 1 0 0 0 0
12 14 2 0 0 0 0
12 38 1 0 0 0 0
13 14 1 0 0 0 0
13 16 2 0 0 0 0
14 15 1 0 0 0 0
15 17 1 0 0 0 0
15 19 2 0 0 0 0
17 20 2 0 0 0 0
18 39 1 0 0 0 0
19 21 1 0 0 0 0
19 40 1 0 0 0 0
20 22 1 0 0 0 0
20 43 1 0 0 0 0
21 22 2 0 0 0 0
21 44 1 0 0 0 0
22 45 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 46 1 0 0 0 0
25 27 2 0 0 0 0
25 47 1 0 0 0 0
26 28 2 0 0 0 0
26 48 1 0 0 0 0
27 28 1 0 0 0 0
27 49 1 0 0 0 0
28 50 1 0 0 0 0
M END
$$$$