L4DRX5
-OEChem-05022323212D
53 56 0 0 0 0 0 0 0999 V2000
9.4651 1.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 1.5427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.4573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
14.7292 0.5219 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
10.3312 0.0427 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.4573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
14.7292 1.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.8232 0.0080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.8232 2.0773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.9292 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.9292 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1972 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1972 1.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4651 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5991 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -1.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.4573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 0.5427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.9573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 0.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 2.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
15.3492 0.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.0372 -0.0163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
15.3401 1.4574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.9383 2.1472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.4186 -0.4618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2168 -0.4710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2168 2.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.4186 2.5471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.0632 2.6627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6603 1.8527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3312 -0.5773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1360 -1.2673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.0773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7130 2.5796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.3527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0930 1.5057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 2 0 0 0 0
2 26 1 0 0 0 0
2 29 1 0 0 0 0
3 27 1 0 0 0 0
3 50 1 0 0 0 0
4 7 1 0 0 0 0
4 8 1 0 0 0 0
4 30 1 0 0 0 0
4 31 1 0 0 0 0
5 14 1 0 0 0 0
5 16 1 0 0 0 0
5 41 1 0 0 0 0
6 20 1 0 0 0 0
6 23 1 0 0 0 0
6 46 1 0 0 0 0
7 9 1 0 0 0 0
7 32 1 0 0 0 0
7 33 1 0 0 0 0
8 10 1 0 0 0 0
8 34 1 0 0 0 0
8 35 1 0 0 0 0
9 11 1 0 0 0 0
9 36 1 0 0 0 0
9 37 1 0 0 0 0
10 11 2 0 0 0 0
10 12 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 15 2 0 0 0 0
13 39 1 0 0 0 0
14 15 1 0 0 0 0
15 40 1 0 0 0 0
16 17 1 0 0 0 0
17 18 2 0 0 0 0
17 19 1 0 0 0 0
18 21 1 0 0 0 0
18 42 1 0 0 0 0
19 22 2 0 0 0 0
19 43 1 0 0 0 0
20 21 2 0 0 0 0
20 22 1 0 0 0 0
21 44 1 0 0 0 0
22 45 1 0 0 0 0
23 24 1 0 0 0 0
23 25 2 0 0 0 0
24 26 2 0 0 0 0
24 47 1 0 0 0 0
25 27 1 0 0 0 0
25 48 1 0 0 0 0
26 28 1 0 0 0 0
27 28 2 0 0 0 0
28 49 1 0 0 0 0
29 51 1 0 0 0 0
29 52 1 0 0 0 0
29 53 1 0 0 0 0
M CHG 1 4 1
M END
$$$$