B2O8NX
-OEChem-04012114072D
43 46 0 1 0 0 0 0 0999 V2000
4.8532 -0.2177 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.2888 -3.0958 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.8920 -2.8745 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
8.5100 -1.6990 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.5442 -1.1687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1622 0.7334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8042 -0.5267 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
6.1132 -1.4777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 0.0611 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
7.4223 -0.5267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 1.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1132 -1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4793 1.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7472 1.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4793 2.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7010 -2.2868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9021 0.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3732 1.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7472 2.5611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 3.0611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3732 3.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 1.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 -0.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2793 1.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2793 2.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7431 1.3785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2079 -0.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1657 0.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9887 -0.7789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7323 0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2103 1.2511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3660 0.4065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2103 2.8711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6132 3.6811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3660 3.7157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1550 1.4844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2879 -1.1842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8150 1.2282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8150 2.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6142 1.9850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7472 -0.6836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4103 0.9010 0.0000 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 7 1 0 0 0 0
1 17 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 8 1 0 0 0 0
7 9 1 0 0 0 0
8 12 2 0 0 0 0
9 10 1 0 0 0 0
9 11 1 0 0 0 0
9 29 1 0 0 0 0
10 12 1 0 0 0 0
10 30 1 0 0 0 0
10 31 1 0 0 0 0
11 13 1 0 0 0 0
11 14 2 0 0 0 0
12 16 1 0 0 0 0
13 15 1 0 0 0 0
13 18 2 0 0 0 0
14 19 1 0 0 0 0
14 32 1 0 0 0 0
15 20 1 0 0 0 0
15 21 2 0 0 0 0
17 22 2 0 0 0 0
17 23 1 0 0 0 0
18 24 1 0 0 0 0
18 33 1 0 0 0 0
19 20 2 0 0 0 0
19 34 1 0 0 0 0
20 35 1 0 0 0 0
21 25 1 0 0 0 0
21 36 1 0 0 0 0
22 26 1 0 0 0 0
22 37 1 0 0 0 0
23 27 2 0 0 0 0
23 38 1 0 0 0 0
24 25 2 0 0 0 0
24 39 1 0 0 0 0
25 40 1 0 0 0 0
26 28 2 0 0 0 0
26 41 1 0 0 0 0
27 28 1 0 0 0 0
27 42 1 0 0 0 0
28 43 1 0 0 0 0
M END
$$$$