HT2LIG000465
3D
Structure written by MMmdl.
78 83 0 0 1 0 999 V2000
-2.2690 -4.2403 -5.3086 C 0 0 0 0 0 0
-1.7426 -2.9542 -5.7376 N 0 0 0 0 0 0
-0.3902 -2.6568 -5.7800 C 0 0 0 0 0 0
-0.2711 -1.3733 -6.2222 C 0 0 0 0 0 0
0.9753 -0.7185 -6.3587 N 0 0 0 0 0 0
1.2426 0.5011 -6.8495 C 0 0 0 0 0 0
0.3920 1.2665 -7.3051 O 0 0 0 0 0 0
2.6757 0.8803 -6.7379 C 0 0 0 0 0 0
3.7607 0.0675 -6.5377 C 0 0 0 0 0 0
4.8991 0.9112 -6.4541 C 0 0 0 0 0 0
6.2276 0.5150 -6.1707 N 0 0 0 0 0 0
6.6984 -0.7819 -6.0600 C 0 0 0 0 0 0
6.1150 -1.8110 -6.3988 O 0 0 0 0 0 0
7.9360 -0.7257 -5.5135 O 0 0 0 0 0 0
8.7441 -1.8734 -5.2162 C 0 0 0 0 0 0
9.9612 -1.2900 -4.4781 C 0 0 0 0 0 0
8.0371 -2.8727 -4.2731 C 0 0 0 0 0 0
9.2208 -2.5556 -6.5140 C 0 0 0 0 0 0
4.5129 2.2049 -6.6428 C 0 0 0 0 0 0
3.1378 2.1996 -6.8323 N 0 0 0 0 0 0
2.3493 3.3987 -7.0654 C 0 0 0 0 0 0
-1.5655 -0.8404 -6.4642 C 0 0 0 0 0 0
-2.4645 -1.8317 -6.1650 C 0 0 0 0 0 0
-3.9484 -1.7961 -6.2149 C 0 0 0 0 0 0
-4.6538 -2.6518 -5.6822 O 0 0 0 0 0 0
-4.4725 -0.7842 -6.9126 N 0 0 0 0 0 0
-5.9054 -0.5915 -7.0871 C 0 0 0 0 0 0
-6.2173 0.7089 -7.8392 C 0 0 0 0 0 0
-7.6333 1.0102 -8.0395 N 0 0 0 0 0 0
-7.9327 2.1912 -8.6728 N 0 0 0 0 0 0
-9.2357 2.1233 -8.6828 C 0 0 0 0 0 0
-10.1396 3.1357 -9.2476 C 0 0 0 0 0 0
-9.5967 4.2982 -9.8366 C 0 0 0 0 0 0
-10.4374 5.2787 -10.3825 C 0 0 0 0 0 0
-11.8280 5.0996 -10.3412 C 0 0 0 0 0 0
-12.3977 3.9500 -9.7594 C 0 0 0 0 0 0
-14.1278 3.8815 -9.7890 Cl 0 0 0 0 0 0
-11.5664 2.9346 -9.1953 C 0 0 0 0 0 0
-12.1546 1.6722 -8.5545 C 0 0 0 0 0 0
-13.3564 1.4250 -8.4720 O 0 0 0 0 0 0
-11.1801 0.6936 -8.0020 C 0 0 0 0 0 0
-11.4631 -0.5345 -7.3659 C 0 0 0 0 0 0
-10.4065 -1.3457 -6.8992 C 0 0 0 0 0 0
-9.0648 -0.9313 -7.0684 C 0 0 0 0 0 0
-8.7696 0.2760 -7.6937 C 0 0 0 0 0 0
-9.8385 1.0253 -8.1269 C 0 0 0 0 0 0
-1.4558 -4.9406 -5.1175 H 0 0 0 0 0 0
-2.8447 -4.1166 -4.3907 H 0 0 0 0 0 0
-2.9116 -4.6581 -6.0837 H 0 0 0 0 0 0
0.3512 -3.3863 -5.4861 H 0 0 0 0 0 0
1.7857 -1.2193 -6.0342 H 0 0 0 0 0 0
3.7334 -1.0077 -6.4363 H 0 0 0 0 0 0
6.8985 1.2257 -5.9295 H 0 0 0 0 0 0
10.4912 -0.5639 -5.0956 H 0 0 0 0 0 0
9.6598 -0.7820 -3.5609 H 0 0 0 0 0 0
10.6722 -2.0698 -4.2027 H 0 0 0 0 0 0
7.6463 -2.3737 -3.3860 H 0 0 0 0 0 0
8.7235 -3.6508 -3.9386 H 0 0 0 0 0 0
7.2040 -3.3814 -4.7583 H 0 0 0 0 0 0
8.3902 -2.9847 -7.0753 H 0 0 0 0 0 0
9.9180 -3.3663 -6.3002 H 0 0 0 0 0 0
9.7292 -1.8469 -7.1685 H 0 0 0 0 0 0
5.0760 3.1273 -6.6563 H 0 0 0 0 0 0
1.8835 3.3490 -8.0506 H 0 0 0 0 0 0
2.9817 4.2856 -7.0232 H 0 0 0 0 0 0
1.5730 3.4870 -6.3050 H 0 0 0 0 0 0
-1.8124 0.1552 -6.8029 H 0 0 0 0 0 0
-3.8281 -0.1360 -7.3384 H 0 0 0 0 0 0
-6.2960 -1.4488 -7.6374 H 0 0 0 0 0 0
-6.3727 -0.5755 -6.1006 H 0 0 0 0 0 0
-5.7777 1.5517 -7.3037 H 0 0 0 0 0 0
-5.7458 0.6842 -8.8226 H 0 0 0 0 0 0
-8.5255 4.4412 -9.8710 H 0 0 0 0 0 0
-10.0161 6.1664 -10.8322 H 0 0 0 0 0 0
-12.4740 5.8560 -10.7626 H 0 0 0 0 0 0
-12.4913 -0.8472 -7.2394 H 0 0 0 0 0 0
-10.6257 -2.2858 -6.4110 H 0 0 0 0 0 0
-8.2895 -1.5796 -6.6959 H 0 0 0 0 0 0
1 2 1 0 0 0
1 47 1 0 0 0
1 48 1 0 0 0
1 49 1 0 0 0
2 23 1 0 0 0
2 3 1 0 0 0
3 4 2 0 0 0
3 50 1 0 0 0
4 5 1 0 0 0
4 22 1 0 0 0
5 6 1 0 0 0
5 51 1 0 0 0
6 7 2 0 0 0
6 8 1 0 0 0
8 20 1 0 0 0
8 9 2 0 0 0
9 10 1 0 0 0
9 52 1 0 0 0
10 11 1 0 0 0
10 19 2 0 0 0
11 12 1 0 0 0
11 53 1 0 0 0
12 13 2 0 0 0
12 14 1 0 0 0
14 15 1 0 0 0
15 16 1 0 0 0
15 17 1 0 0 0
15 18 1 0 0 0
16 54 1 0 0 0
16 55 1 0 0 0
16 56 1 0 0 0
17 57 1 0 0 0
17 58 1 0 0 0
17 59 1 0 0 0
18 60 1 0 0 0
18 61 1 0 0 0
18 62 1 0 0 0
19 20 1 0 0 0
19 63 1 0 0 0
20 21 1 0 0 0
21 64 1 0 0 0
21 65 1 0 0 0
21 66 1 0 0 0
22 23 2 0 0 0
22 67 1 0 0 0
23 24 1 0 0 0
24 25 2 0 0 0
24 26 1 0 0 0
26 27 1 0 0 0
26 68 1 0 0 0
27 28 1 0 0 0
27 69 1 0 0 0
27 70 1 0 0 0
28 29 1 0 0 0
28 71 1 0 0 0
28 72 1 0 0 0
29 45 1 0 0 0
29 30 1 0 0 0
30 31 2 0 0 0
31 46 1 0 0 0
31 32 1 0 0 0
32 38 2 0 0 0
32 33 1 0 0 0
33 34 2 0 0 0
33 73 1 0 0 0
34 35 1 0 0 0
34 74 1 0 0 0
35 36 2 0 0 0
35 75 1 0 0 0
36 37 1 0 0 0
36 38 1 0 0 0
38 39 1 0 0 0
39 40 2 0 0 0
39 41 1 0 0 0
41 46 1 0 0 0
41 42 2 0 0 0
42 43 1 0 0 0
42 76 1 0 0 0
43 44 2 0 0 0
43 77 1 0 0 0
44 45 1 0 0 0
44 78 1 0 0 0
45 46 2 0 0 0
M END
> <s_m_entry_id>
364060
> <s_m_entry_name>
HT2LIG000465.1
$$$$