D0PM7Q
-OEChem-10121504072D
44 46 0 1 0 0 0 0 0999 V2000
6.0600 -0.2997 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.1370 -3.8874 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
6.1880 2.3739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3580 0.4423 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6166 2.8694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.7867 1.3559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.9568 1.4604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.5391 2.1649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1989 2.1649 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.6056 3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0179 3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2044 2.0604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0233 3.7829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7812 1.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3690 0.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3690 0.6514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8690 -0.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6780 -0.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8690 -1.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0030 -2.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7350 -2.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9513 1.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0030 -3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7350 -3.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8690 -3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9467 1.5985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1196 2.7317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0363 3.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5751 4.1592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8470 4.4834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6471 1.7886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3753 1.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0666 4.4014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4218 3.9329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.8046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5345 0.7895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2677 -0.4913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7046 2.0268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4660 -2.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2720 -2.0775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2720 -3.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8690 -4.5075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1557 2.1001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2869 2.7313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
1 17 1 0 0 0 0
2 23 1 0 0 0 0
3 14 2 0 0 0 0
4 22 2 0 0 0 0
5 12 1 0 0 0 0
5 13 1 0 0 0 0
5 35 1 0 0 0 0
9 6 1 6 0 0 0
6 14 1 0 0 0 0
6 36 1 0 0 0 0
7 16 1 0 0 0 0
7 22 1 0 0 0 0
7 38 1 0 0 0 0
8 22 1 0 0 0 0
8 43 1 0 0 0 0
8 44 1 0 0 0 0
9 10 1 0 0 0 0
9 12 1 0 0 0 0
9 26 1 0 0 0 0
10 11 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
11 13 1 0 0 0 0
11 29 1 0 0 0 0
11 30 1 0 0 0 0
12 31 1 0 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 15 1 0 0 0 0
15 16 2 0 0 0 0
16 18 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
18 37 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
20 23 1 0 0 0 0
20 39 1 0 0 0 0
21 24 2 0 0 0 0
21 40 1 0 0 0 0
23 25 2 0 0 0 0
24 25 1 0 0 0 0
24 41 1 0 0 0 0
25 42 1 0 0 0 0
M END
$$$$