BAG5Y1
-OEChem-04012116142D
68 71 0 1 0 0 0 0 0999 V2000
2.0000 -1.1118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.4699 1.8440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
15.9301 0.8306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.8660 0.3540 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 -0.6327 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
15.0621 0.3339 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1301 -0.6393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1340 0.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9942 -1.1427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2622 -1.1360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0019 0.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8622 -0.6460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3981 0.4090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4920 -1.1465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7340 0.8506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4920 0.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.6118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.3882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5981 0.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.1118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.8882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.6118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.3882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4660 0.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.5942 -0.6527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4583 -1.1560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.3301 0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.3262 -0.6594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4544 -2.1560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
14.1980 0.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.1118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.8882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1277 -1.2593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9242 0.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5230 0.2553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5939 -1.6161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3909 -1.6192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8618 -1.6094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6589 -1.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4023 1.3307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6052 1.3338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0720 -1.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4732 -0.5407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0089 0.3029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6071 0.9927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0874 -1.6163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8856 -1.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1343 1.3240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3373 1.3271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8856 1.4018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0874 1.3926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0561 -0.9606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.8620 -0.9714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.8344 -2.1536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.4520 -2.7760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.0744 -2.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.9341 2.1560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2004 1.4573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 -2.1118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 -2.1118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 1.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.5082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 1.8882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
16.4658 0.5185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 23 1 0 0 0 0
1 32 1 0 0 0 0
2 24 1 0 0 0 0
2 33 1 0 0 0 0
3 25 1 0 0 0 0
3 60 1 0 0 0 0
4 7 1 0 0 0 0
4 68 1 0 0 0 0
5 12 1 0 0 0 0
5 13 1 0 0 0 0
5 16 1 0 0 0 0
6 11 1 0 0 0 0
6 14 1 0 0 0 0
6 15 1 0 0 0 0
7 31 2 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 11 1 0 0 0 0
8 34 1 0 0 0 0
9 12 1 0 0 0 0
9 35 1 0 0 0 0
9 36 1 0 0 0 0
10 13 1 0 0 0 0
10 37 1 0 0 0 0
10 38 1 0 0 0 0
11 39 1 0 0 0 0
11 40 1 0 0 0 0
12 41 1 0 0 0 0
12 42 1 0 0 0 0
13 43 1 0 0 0 0
13 44 1 0 0 0 0
14 17 1 0 0 0 0
14 45 1 0 0 0 0
14 46 1 0 0 0 0
15 18 1 0 0 0 0
15 47 1 0 0 0 0
15 48 1 0 0 0 0
16 20 1 0 0 0 0
16 49 1 0 0 0 0
16 50 1 0 0 0 0
17 19 1 0 0 0 0
17 51 1 0 0 0 0
17 52 1 0 0 0 0
18 19 1 0 0 0 0
18 21 2 0 0 0 0
19 22 2 0 0 0 0
20 25 2 0 0 0 0
20 26 1 0 0 0 0
21 23 1 0 0 0 0
21 53 1 0 0 0 0
22 24 1 0 0 0 0
22 54 1 0 0 0 0
23 24 2 0 0 0 0
25 28 1 0 0 0 0
26 27 2 0 0 0 0
26 55 1 0 0 0 0
27 29 1 0 0 0 0
27 30 1 0 0 0 0
28 29 2 0 0 0 0
28 31 1 0 0 0 0
29 56 1 0 0 0 0
30 57 1 0 0 0 0
30 58 1 0 0 0 0
30 59 1 0 0 0 0
31 61 1 0 0 0 0
32 62 1 0 0 0 0
32 63 1 0 0 0 0
32 64 1 0 0 0 0
33 65 1 0 0 0 0
33 66 1 0 0 0 0
33 67 1 0 0 0 0
M END
$$$$