BBT95P
-OEChem-04022109073D
28 29 0 0 0 0 0 0 0999 V2000
6.1088 -1.0509 0.0043 Cl 0 0 0 0 0 0 0 0 0 0 0 0
0.3987 2.3692 -0.1216 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1405 -2.9236 0.1897 O 0 5 0 0 0 0 0 0 0 0 0 0
-1.0612 -2.2207 0.1565 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4708 0.1938 0.0092 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.2946 -2.0005 0.1365 N 0 3 0 0 0 0 0 0 0 0 0 0
-1.8702 0.4127 -0.0115 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7509 -0.6551 0.0499 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9141 0.6066 -0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5615 1.1408 -0.0444 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3266 1.7189 -0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1241 -0.4110 0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9634 1.3758 0.4709 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1620 -0.6749 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6997 1.9630 -0.1178 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5986 0.8982 -0.0568 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2608 0.8632 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4593 -1.1873 -0.5128 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5087 -0.4183 -0.0099 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1907 -0.7709 0.1245 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7067 2.6002 -0.1463 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8573 -1.2122 0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7911 2.3746 0.8636 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3886 -1.2942 -0.9675 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0708 2.9818 -0.1831 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6677 1.0889 -0.0745 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0686 1.4732 0.8781 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6399 -2.1837 -0.9081 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 10 2 0 0 0 0
3 6 1 0 0 0 0
4 6 2 0 0 0 0
5 7 1 0 0 0 0
5 10 1 0 0 0 0
5 20 1 0 0 0 0
6 8 1 0 0 0 0
7 8 1 0 0 0 0
7 11 2 0 0 0 0
8 12 2 0 0 0 0
9 10 1 0 0 0 0
9 13 2 0 0 0 0
9 14 1 0 0 0 0
11 15 1 0 0 0 0
11 21 1 0 0 0 0
12 16 1 0 0 0 0
12 22 1 0 0 0 0
13 17 1 0 0 0 0
13 23 1 0 0 0 0
14 18 2 0 0 0 0
14 24 1 0 0 0 0
15 16 2 0 0 0 0
15 25 1 0 0 0 0
16 26 1 0 0 0 0
17 19 2 0 0 0 0
17 27 1 0 0 0 0
18 19 1 0 0 0 0
18 28 1 0 0 0 0
M CHG 2 3 -1 6 1
M END
$$$$