B1JL3E
-OEChem-04012113153D
44 46 0 0 0 0 0 0 0999 V2000
-1.7974 5.6911 0.5554 Cl 0 0 0 0 0 0 0 0 0 0 0 0
5.1479 -1.4714 0.4930 S 0 0 0 0 0 0 0 0 0 0 0 0
-4.9427 -1.9401 0.2870 S 0 0 0 0 0 0 0 0 0 0 0 0
5.3065 -0.2278 1.2228 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5135 -2.6215 1.1089 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0312 -2.9288 1.3522 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.7223 -0.7128 0.3735 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7629 -0.5413 -0.4326 N 0 0 0 0 0 0 0 0 0 0 0 0
2.6219 0.6629 -0.5931 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9059 -0.6688 -0.7652 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3204 0.7094 -0.3942 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2854 -1.1140 -1.0143 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5816 -0.8708 -0.2623 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7684 -1.4355 -0.6698 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5645 1.9162 -0.1642 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2595 -1.5273 0.0751 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9218 -2.1016 0.2839 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5627 0.0360 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2667 -2.4312 0.4532 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9074 -0.2937 -0.4726 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7545 -1.9767 -0.0721 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0214 2.6150 -1.2421 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3770 2.3844 1.1364 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3973 -2.7364 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7092 3.7824 -1.0196 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3536 3.5516 1.3588 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8967 4.2507 0.2809 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8517 -0.3379 -1.5391 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2986 -2.0234 -1.6236 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6183 -2.5024 -0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1762 -2.8223 0.6072 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4079 0.9133 -1.2341 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5179 -3.3985 0.8793 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6665 0.4046 -0.8146 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3619 -2.2195 0.8022 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6441 -2.8576 -0.7072 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2086 -1.1532 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1744 2.2758 -2.2646 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7940 1.8505 1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7750 -3.6228 -1.3738 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4479 -3.0264 -1.1675 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2587 -2.0334 -2.0606 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1231 4.3190 -1.8694 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4918 3.9046 2.3776 H 0 0 0 0 0 0 0 0 0 0 0 0
1 27 1 0 0 0 0
2 4 2 0 0 0 0
2 5 2 0 0 0 0
2 12 1 0 0 0 0
2 21 1 0 0 0 0
3 6 2 0 0 0 0
3 7 2 0 0 0 0
3 16 1 0 0 0 0
3 24 1 0 0 0 0
8 11 1 0 0 0 0
8 13 1 0 0 0 0
8 14 1 0 0 0 0
9 10 1 0 0 0 0
9 11 2 0 0 0 0
10 12 1 0 0 0 0
10 14 2 0 0 0 0
11 15 1 0 0 0 0
12 28 1 0 0 0 0
12 29 1 0 0 0 0
13 17 2 0 0 0 0
13 18 1 0 0 0 0
14 30 1 0 0 0 0
15 22 2 0 0 0 0
15 23 1 0 0 0 0
16 19 2 0 0 0 0
16 20 1 0 0 0 0
17 19 1 0 0 0 0
17 31 1 0 0 0 0
18 20 2 0 0 0 0
18 32 1 0 0 0 0
19 33 1 0 0 0 0
20 34 1 0 0 0 0
21 35 1 0 0 0 0
21 36 1 0 0 0 0
21 37 1 0 0 0 0
22 25 1 0 0 0 0
22 38 1 0 0 0 0
23 26 2 0 0 0 0
23 39 1 0 0 0 0
24 40 1 0 0 0 0
24 41 1 0 0 0 0
24 42 1 0 0 0 0
25 27 2 0 0 0 0
25 43 1 0 0 0 0
26 27 1 0 0 0 0
26 44 1 0 0 0 0
M END
$$$$