BS3Z5X
-OEChem-04022106572D
46 48 0 1 0 0 0 0 0999 V2000
2.8660 3.7012 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
4.3211 -0.7984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 0.8964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.2781 -1.2108 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
6.8994 -3.1118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 2.5059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 1.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 1.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4883 3.0923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3709 3.4575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2566 -1.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5673 -2.3676 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.9674 -0.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -0.0541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6103 -1.9551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9209 -2.9056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5458 -2.5738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7227 1.2865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7227 2.1159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8704 -1.3297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2772 -0.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8519 2.5901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9905 3.4558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1248 3.5945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9609 3.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1803 4.0475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7809 3.2669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7599 -2.9569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5812 -0.1729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9880 0.3594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2277 -1.4672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0633 -2.2471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3071 -2.9930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9004 -3.5253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0920 -3.7012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.0812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4179 -3.1804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1524 -2.7016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6736 -1.9671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 2.5112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.8912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 18 1 0 0 0 0
2 15 2 0 0 0 0
3 7 1 0 0 0 0
3 9 1 0 0 0 0
3 15 1 0 0 0 0
4 12 1 0 0 0 0
4 14 1 0 0 0 0
4 16 1 0 0 0 0
5 13 1 0 0 0 0
5 17 1 0 0 0 0
5 40 1 0 0 0 0
6 7 1 0 0 0 0
6 8 1 0 0 0 0
6 10 1 0 0 0 0
6 11 1 0 0 0 0
7 23 1 0 0 0 0
7 24 1 0 0 0 0
8 9 2 0 0 0 0
8 18 1 0 0 0 0
9 19 1 0 0 0 0
10 27 1 0 0 0 0
10 28 1 0 0 0 0
10 29 1 0 0 0 0
11 30 1 0 0 0 0
11 31 1 0 0 0 0
11 32 1 0 0 0 0
12 13 1 0 0 0 0
12 25 1 0 0 0 0
12 26 1 0 0 0 0
13 20 1 1 0 0 0
13 33 1 0 0 0 0
14 15 1 0 0 0 0
14 34 1 0 0 0 0
14 35 1 0 0 0 0
16 17 1 0 0 0 0
16 36 1 0 0 0 0
16 37 1 0 0 0 0
17 38 1 0 0 0 0
17 39 1 0 0 0 0
18 21 2 0 0 0 0
19 22 2 0 0 0 0
19 41 1 0 0 0 0
20 42 1 0 0 0 0
20 43 1 0 0 0 0
20 44 1 0 0 0 0
21 22 1 0 0 0 0
21 45 1 0 0 0 0
22 46 1 0 0 0 0
M END
$$$$