D0NU3J
-OEChem-04152109502D
25 27 0 0 0 0 0 0 0999 V2000
8.3764 -1.7403 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
5.5047 1.1203 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.9773 -0.0039 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
5.0047 -0.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6957 0.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0047 -0.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3137 0.5325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6803 0.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3197 -1.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6897 -1.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2992 -0.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3291 0.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7102 -0.9946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0321 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5047 1.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4955 1.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5181 -1.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4913 -1.7907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8861 -1.4569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5139 1.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6380 0.1273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1312 0.8137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3940 0.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8688 -0.3982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
2 5 1 0 0 0 0
2 7 1 0 0 0 0
2 16 1 0 0 0 0
3 8 2 0 0 0 0
3 11 1 0 0 0 0
3 15 1 0 0 0 0
4 5 2 0 0 0 0
4 6 1 0 0 0 0
4 9 1 0 0 0 0
5 8 1 0 0 0 0
6 7 2 0 0 0 0
6 10 1 0 0 0 0
7 12 1 0 0 0 0
8 17 1 0 0 0 0
9 11 2 0 0 0 0
9 18 1 0 0 0 0
10 13 2 0 0 0 0
10 19 1 0 0 0 0
11 20 1 0 0 0 0
12 14 2 0 0 0 0
12 21 1 0 0 0 0
13 14 1 0 0 0 0
14 22 1 0 0 0 0
15 23 1 0 0 0 0
15 24 1 0 0 0 0
15 25 1 0 0 0 0
M CHG 1 3 1
M END
$$$$