D07JBE
04191100542D 1 1.00000 0.00000 0
31 32 0 0 0 999 V2000
1.1819 -1.0666 0.0000 C 0 0 0 0 0 0 0 0 0
1.1807 -1.7773 0.0000 C 0 0 0 0 0 0 0 0 0
1.7956 -2.1319 0.0000 C 0 0 0 0 0 0 0 0 0
1.7938 -0.7122 0.0000 C 0 0 0 0 0 0 0 0 0
2.4050 -1.0630 0.0000 C 0 0 0 0 0 0 0 0 0
2.4060 -1.7737 0.0000 C 0 0 0 0 0 0 0 0 0
3.0211 -2.1266 0.0000 C 0 0 0 0 0 0 0 0 0
3.6354 -1.7697 0.0000 C 0 0 0 0 0 0 0 0 0
3.6309 -1.0563 0.0000 C 0 0 0 0 0 0 0 0 0
3.0154 -0.7067 0.0000 C 0 0 0 0 0 0 0 0 0
3.0229 -2.8349 0.0000 O 0 0 0 0 0 0 0 0 0
3.6373 -3.1874 0.0000 C 0 0 0 0 0 0 0 0 0
3.6392 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0
4.2535 -4.2483 0.0000 C 0 0 0 0 0 0 0 0 0
3.0267 -4.2516 0.0000 C 0 0 3 0 0 0 0 0 0
4.8660 -3.8925 0.0000 C 0 0 0 0 0 0 0 0 0
5.4804 -4.2451 0.0000 C 0 0 0 0 0 0 0 0 0
6.0929 -3.8893 0.0000 C 0 0 0 0 0 0 0 0 0
6.7073 -4.2419 0.0000 C 0 0 0 0 0 0 0 0 0
7.3198 -3.8861 0.0000 C 0 0 0 0 0 0 0 0 0
7.9341 -4.2386 0.0000 N 0 0 0 0 0 0 0 0 0
7.3179 -3.1777 0.0000 O 0 0 0 0 0 0 0 0 0
7.9360 -4.9470 0.0000 O 0 0 0 0 0 0 0 0 0
3.0285 -4.9599 0.0000 O 0 0 0 0 0 0 0 0 0
2.4123 -3.8990 0.0000 N 0 0 0 0 0 0 0 0 0
1.7998 -4.2548 0.0000 C 0 0 0 0 0 0 0 0 0
1.1854 -3.9022 0.0000 C 0 0 0 0 0 0 0 0 0
0.5729 -4.2580 0.0000 C 0 0 0 0 0 0 0 0 0
-0.0414 -3.9055 0.0000 N 0 0 3 0 0 0 0 0 0
-0.6539 -4.2613 0.0000 C 0 0 0 0 0 0 0 0 0
-0.0433 -3.1971 0.0000 C 0 0 0 0 0 0 0 0 0
13 15 1 0 0 0
1 2 2 0 0 0
14 16 1 0 0 0
7 8 2 0 0 0
16 17 1 0 0 0
5 4 2 0 0 0
17 18 1 0 0 0
8 9 1 0 0 0
18 19 1 0 0 0
4 1 1 0 0 0
19 20 1 0 0 0
9 10 2 0 0 0
20 21 1 0 0 0
10 5 1 0 0 0
20 22 2 0 0 0
21 23 1 0 0 0
7 11 1 0 0 0
15 24 1 0 0 0
2 3 1 0 0 0
15 25 1 0 0 0
11 12 1 0 0 0
25 26 1 0 0 0
5 6 1 0 0 0
26 27 1 0 0 0
12 13 1 0 0 0
27 28 1 0 0 0
3 6 2 0 0 0
28 29 1 0 0 0
13 14 2 0 0 0
29 30 1 0 0 0
6 7 1 0 0 0
29 31 1 0 0 0
M END
$$$$