BUV59E
-OEChem-04022102582D
46 48 0 0 0 0 0 0 0999 V2000
2.0000 1.1031 0.0000 K 0 3 0 0 0 0 0 0 0 0 0 0
2.9511 0.7940 0.0000 S 0 5 0 0 0 0 0 0 0 0 0 0
7.4758 -5.9092 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
4.5032 -3.2326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0725 -0.5908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9898 -1.7933 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4898 -0.9272 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.9385 -0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9385 0.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9680 -1.5854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9385 2.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8046 1.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0725 1.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8046 2.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0725 2.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7111 -2.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 -0.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9385 3.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0725 4.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8046 4.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2464 -3.9018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0725 5.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8046 5.4092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9385 5.9092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1974 -3.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0384 -4.8799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9406 -4.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7816 -5.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7326 -5.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1506 -0.6734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5491 0.0168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3415 1.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5356 1.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3415 2.7192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5356 2.7192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2860 -2.4867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0397 -1.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5356 4.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3415 4.0992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5356 5.7192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3415 5.7192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9385 6.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3263 -2.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4488 -5.0715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5302 -4.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6527 -6.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2 17 1 0 0 0 0
3 29 1 0 0 0 0
4 16 1 0 0 0 0
4 21 1 0 0 0 0
5 8 1 0 0 0 0
5 10 1 0 0 0 0
5 17 1 0 0 0 0
6 7 1 0 0 0 0
6 10 2 0 0 0 0
7 17 2 0 0 0 0
8 9 1 0 0 0 0
8 30 1 0 0 0 0
8 31 1 0 0 0 0
9 12 2 0 0 0 0
9 13 1 0 0 0 0
10 16 1 0 0 0 0
11 14 2 0 0 0 0
11 15 1 0 0 0 0
11 18 1 0 0 0 0
12 14 1 0 0 0 0
12 32 1 0 0 0 0
13 15 2 0 0 0 0
13 33 1 0 0 0 0
14 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
18 19 2 0 0 0 0
18 20 1 0 0 0 0
19 22 1 0 0 0 0
19 38 1 0 0 0 0
20 23 2 0 0 0 0
20 39 1 0 0 0 0
21 25 2 0 0 0 0
21 26 1 0 0 0 0
22 24 2 0 0 0 0
22 40 1 0 0 0 0
23 24 1 0 0 0 0
23 41 1 0 0 0 0
24 42 1 0 0 0 0
25 27 1 0 0 0 0
25 43 1 0 0 0 0
26 28 2 0 0 0 0
26 44 1 0 0 0 0
27 29 2 0 0 0 0
27 45 1 0 0 0 0
28 29 1 0 0 0 0
28 46 1 0 0 0 0
M CHG 2 1 1 2 -1
M END
$$$$