BWZ74U
-OEChem-04022102033D
44 47 0 1 0 0 0 0 0999 V2000
0.3768 -1.3709 0.4310 S 0 0 0 0 0 0 0 0 0 0 0 0
5.1793 3.0003 -0.3868 F 0 0 0 0 0 0 0 0 0 0 0 0
6.3932 1.5092 0.6284 F 0 0 0 0 0 0 0 0 0 0 0 0
6.1234 1.4035 -1.5209 F 0 0 0 0 0 0 0 0 0 0 0 0
-2.0778 1.6836 0.5852 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9541 -0.3547 -1.4773 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2352 -3.4131 -0.9319 O 0 5 0 0 0 0 0 0 0 0 0 0
3.5065 -3.3034 1.2437 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.9546 -0.0641 -0.3588 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5777 -0.5398 0.7595 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5449 1.1986 0.2834 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3149 -2.7611 0.1328 N 0 3 0 0 0 0 0 0 0 0 0 0
-6.8110 -0.3253 -1.5065 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7482 0.2241 0.8318 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.1996 -0.5034 -0.9123 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.1653 0.4085 0.3076 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5748 -0.1017 -0.4435 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8366 0.1999 0.8360 C 0 0 2 0 0 0 0 0 0 0 0 0
-3.4553 1.6550 0.9371 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6869 0.3877 0.6023 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2952 0.2020 0.4377 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9440 -0.6895 0.2009 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8335 0.7032 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1820 -1.3406 0.0777 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3259 -0.5593 -0.1045 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2409 0.8274 -0.1623 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0051 1.4691 -0.0389 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6690 -1.2124 -0.2405 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4625 1.6670 -0.3567 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4641 -1.2021 -2.0611 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7632 0.5505 -2.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3768 1.1116 1.3513 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6818 -0.6423 1.4987 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3418 -1.5430 -0.5934 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9958 -0.2475 -1.6165 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3179 1.4489 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9261 0.1579 1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3978 -0.1327 1.7125 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0204 2.3086 0.2652 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5558 2.0315 1.9605 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9231 2.5513 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3365 -0.8805 0.5615 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6582 -2.3036 -0.1871 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1161 -0.9654 -1.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
1 21 1 0 0 0 0
1 22 1 0 0 0 0
2 29 1 0 0 0 0
3 29 1 0 0 0 0
4 29 1 0 0 0 0
5 19 1 0 0 0 0
5 20 1 0 0 0 0
6 17 2 0 0 0 0
7 12 1 0 0 0 0
8 12 2 0 0 0 0
9 13 1 0 0 0 0
9 14 1 0 0 0 0
9 17 1 0 0 0 0
10 18 1 0 0 0 0
10 20 2 0 0 0 0
11 21 2 0 0 0 0
11 23 1 0 0 0 0
12 24 1 0 0 0 0
13 15 1 0 0 0 0
13 30 1 0 0 0 0
13 31 1 0 0 0 0
14 16 1 0 0 0 0
14 32 1 0 0 0 0
14 33 1 0 0 0 0
15 16 1 0 0 0 0
15 34 1 0 0 0 0
15 35 1 0 0 0 0
16 36 1 0 0 0 0
16 37 1 0 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
18 38 1 0 0 0 0
19 39 1 0 0 0 0
19 40 1 0 0 0 0
20 21 1 0 0 0 0
22 23 2 0 0 0 0
22 24 1 0 0 0 0
23 27 1 0 0 0 0
24 25 2 0 0 0 0
25 26 1 0 0 0 0
25 28 1 0 0 0 0
26 27 2 0 0 0 0
26 29 1 0 0 0 0
27 41 1 0 0 0 0
28 42 1 0 0 0 0
28 43 1 0 0 0 0
28 44 1 0 0 0 0
M CHG 2 7 -1 12 1
M END
$$$$