HT2LIG000334
3D
Structure written by MMmdl.
31 34 0 0 1 0 999 V2000
-6.1796 -0.1664 -0.2031 C 0 0 0 0 0 0
-5.0008 -0.9353 -0.0158 O 0 0 0 0 0 0
-3.7940 -0.2721 0.0338 C 0 0 0 0 0 0
-3.6565 1.1349 0.0272 C 0 0 0 0 0 0
-2.3789 1.7240 0.0676 C 0 0 0 0 0 0
-1.2051 0.9350 0.1110 C 0 0 0 0 0 0
0.1091 1.6550 0.1300 C 0 0 0 0 0 0
0.2141 2.8846 0.1436 O 0 0 0 0 0 0
1.3007 0.8317 0.1111 C 0 0 0 0 0 0
2.5792 1.3618 0.0693 N 0 0 0 0 0 0
3.5130 0.3438 0.0449 C 0 0 0 0 0 0
4.9175 0.3508 -0.0076 C 0 0 0 0 0 0
5.6145 -0.8721 -0.0236 C 0 0 0 0 0 0
4.9019 -2.0870 0.0160 C 0 0 0 0 0 0
3.4921 -2.0854 0.0694 C 0 0 0 0 0 0
2.7636 -0.8738 0.0832 C 0 0 0 0 0 0
1.3716 -0.5221 0.1244 C 0 0 0 0 0 0
0.0292 -1.6239 0.1718 S 0 0 0 0 0 0
-1.3443 -0.4878 0.1256 C 0 0 0 0 0 0
-2.6314 -1.0624 0.0929 C 0 0 0 0 0 0
2.7431 2.3585 0.0537 H 0 0 0 0 0 0
-7.0366 -0.8354 -0.2805 H 0 0 0 0 0 0
-6.3587 0.5024 0.6394 H 0 0 0 0 0 0
-6.1336 0.4156 -1.1245 H 0 0 0 0 0 0
-4.5162 1.7868 -0.0096 H 0 0 0 0 0 0
-2.3061 2.8027 0.0583 H 0 0 0 0 0 0
5.4601 1.2834 -0.0382 H 0 0 0 0 0 0
6.6950 -0.8800 -0.0661 H 0 0 0 0 0 0
5.4386 -3.0257 0.0040 H 0 0 0 0 0 0
2.9483 -3.0179 0.0979 H 0 0 0 0 0 0
-2.7322 -2.1379 0.1014 H 0 0 0 0 0 0
1 2 1 0 0 0
1 22 1 0 0 0
1 23 1 0 0 0
1 24 1 0 0 0
2 3 1 0 0 0
3 20 1 0 0 0
3 4 2 0 0 0
4 5 1 0 0 0
4 25 1 0 0 0
5 6 2 0 0 0
5 26 1 0 0 0
6 19 1 0 0 0
6 7 1 0 0 0
7 8 2 0 0 0
7 9 1 0 0 0
9 17 2 0 0 0
9 10 1 0 0 0
10 21 1 0 0 0
10 11 1 0 0 0
11 16 1 0 0 0
11 12 2 0 0 0
12 13 1 0 0 0
12 27 1 0 0 0
13 14 2 0 0 0
13 28 1 0 0 0
14 15 1 0 0 0
14 29 1 0 0 0
15 16 2 0 0 0
15 30 1 0 0 0
16 17 1 0 0 0
17 18 1 0 0 0
18 19 1 0 0 0
19 20 2 0 0 0
20 31 1 0 0 0
M END
> <s_m_entry_id>
364191
> <s_m_entry_name>
HT2LIG000334.1
$$$$