BS0KB8
-OEChem-04022105332D
64 69 0 0 0 0 0 0 0999 V2000
9.0209 2.4941 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
7.4421 -5.1218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.2569 -1.3101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.9719 2.8031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0698 2.1851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
12.5401 -5.3473 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0
12.8936 -3.6517 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.6097 -1.8454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.3299 1.5431 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.2274 -4.3974 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
7.9405 -2.5885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2496 -3.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9465 -2.5911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3006 -0.8943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2277 -3.7475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6401 -3.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4438 -4.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8968 -3.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5878 -2.0533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9698 -0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2649 -1.8116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6309 -3.7685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6608 0.7999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5343 -4.7430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9315 -3.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.9189 -3.2052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2506 -2.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.2484 -4.1933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5514 -4.9674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9543 -3.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2817 -2.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6498 -4.1700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7119 3.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3045 -2.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6726 -4.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3810 4.1883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7337 3.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.6426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0720 5.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4247 4.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0938 5.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9189 -0.4057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7532 -1.1854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3515 -0.6397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5172 0.1399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4628 -1.2240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4466 -4.3605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2791 1.2885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1133 0.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1141 -5.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.3284 -2.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8371 -1.5579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7408 -5.5578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9363 1.4142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4705 -1.8870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0668 -4.6288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8875 -2.2313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4838 -4.9731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9875 4.0594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3189 3.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3942 -3.7743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4868 5.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8182 4.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9022 5.9369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 4 2 0 0 0 0
1 5 2 0 0 0 0
1 9 1 0 0 0 0
1 33 1 0 0 0 0
2 17 2 0 0 0 0
3 19 2 0 0 0 0
6 10 1 0 0 0 0
7 10 2 0 0 0 0
8 11 1 0 0 0 0
8 14 1 0 0 0 0
8 19 1 0 0 0 0
9 23 1 0 0 0 0
9 54 1 0 0 0 0
10 28 1 0 0 0 0
11 12 2 0 0 0 0
11 13 1 0 0 0 0
12 15 1 0 0 0 0
12 17 1 0 0 0 0
13 16 2 0 0 0 0
13 21 1 0 0 0 0
14 20 1 0 0 0 0
14 42 1 0 0 0 0
14 43 1 0 0 0 0
15 18 2 0 0 0 0
15 24 1 0 0 0 0
16 17 1 0 0 0 0
16 22 1 0 0 0 0
18 19 1 0 0 0 0
18 26 1 0 0 0 0
20 23 1 0 0 0 0
20 44 1 0 0 0 0
20 45 1 0 0 0 0
21 27 2 0 0 0 0
21 46 1 0 0 0 0
22 25 2 0 0 0 0
22 47 1 0 0 0 0
23 48 1 0 0 0 0
23 49 1 0 0 0 0
24 29 2 0 0 0 0
24 50 1 0 0 0 0
25 27 1 0 0 0 0
25 30 1 0 0 0 0
26 28 2 0 0 0 0
26 51 1 0 0 0 0
27 52 1 0 0 0 0
28 29 1 0 0 0 0
29 53 1 0 0 0 0
30 31 2 0 0 0 0
30 32 1 0 0 0 0
31 34 1 0 0 0 0
31 55 1 0 0 0 0
32 35 2 0 0 0 0
32 56 1 0 0 0 0
33 36 2 0 0 0 0
33 37 1 0 0 0 0
34 38 2 0 0 0 0
34 57 1 0 0 0 0
35 38 1 0 0 0 0
35 58 1 0 0 0 0
36 39 1 0 0 0 0
36 59 1 0 0 0 0
37 40 2 0 0 0 0
37 60 1 0 0 0 0
38 61 1 0 0 0 0
39 41 2 0 0 0 0
39 62 1 0 0 0 0
40 41 1 0 0 0 0
40 63 1 0 0 0 0
41 64 1 0 0 0 0
M CHG 2 6 -1 10 1
M END
$$$$