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Copy path5bvn_ligand.sdf
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5bvn_ligand.sdf
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5bvn_ligand.pdb
OpenBabel07032307043D
51 54 0 0 0 0 0 0 0 0999 V2000
22.7220 41.1920 38.2990 C 0 0 0 0 0 0 0 0 0 0 0 0
22.7040 39.6890 38.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
23.7930 38.9590 38.6570 C 0 0 0 0 0 0 0 0 0 0 0 0
22.7490 36.8870 38.0210 C 0 0 0 0 0 0 0 0 0 0 0 0
22.7560 35.3790 37.9410 C 0 0 0 0 0 0 0 0 0 0 0 0
23.9640 34.0830 36.2390 C 0 0 0 0 0 0 0 0 0 0 0 0
22.9870 34.0100 35.5020 O 0 0 0 0 0 0 0 0 0 0 0 0
25.3430 32.4250 35.0020 C 0 0 0 0 0 0 0 0 0 0 0 0
26.2940 31.4380 35.2320 C 0 0 0 0 0 0 0 0 0 0 0 0
26.5180 30.4540 34.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
25.7800 30.4400 33.1140 C 0 0 0 0 0 0 0 0 0 0 0 0
24.8370 31.4050 32.9190 C 0 0 0 0 0 0 0 0 0 0 0 0
21.6290 39.0000 37.6200 C 0 0 0 0 0 0 0 0 0 0 0 0
19.2180 39.4830 37.5420 C 0 0 0 0 0 0 0 0 0 0 0 0
18.1430 40.1330 36.7640 C 0 0 0 0 0 0 0 0 0 0 0 0
18.1970 40.7960 35.5650 C 0 0 0 0 0 0 0 0 0 0 0 0
16.1060 40.7960 36.1290 C 0 0 0 0 0 0 0 0 0 0 0 0
14.7130 40.9450 36.2770 C 0 0 0 0 0 0 0 0 0 0 0 0
14.0620 40.3810 37.3640 C 0 0 0 0 0 0 0 0 0 0 0 0
23.8100 37.5770 38.5830 C 0 0 0 0 0 0 0 0 0 0 0 0
23.9700 34.8360 37.3570 N 0 0 0 0 0 0 0 0 0 0 0 0
25.1370 33.4130 35.9880 N 0 0 0 0 0 0 0 0 0 0 0 0
24.1150 31.3910 31.7640 F 0 0 0 0 0 0 0 0 0 0 0 0
24.6030 32.3980 33.8240 C 0 0 0 0 0 0 0 0 0 0 0 0
21.6650 37.6130 37.5450 C 0 0 0 0 0 0 0 0 0 0 0 0
20.5000 39.7000 37.1390 N 0 0 0 0 0 0 0 0 0 0 0 0
18.9560 38.7740 38.5140 O 0 0 0 0 0 0 0 0 0 0 0 0
16.9470 41.2140 35.1790 N 0 0 0 0 0 0 0 0 0 0 0 0
14.7820 39.7110 38.3360 C 0 0 0 0 0 0 0 0 0 0 0 0
16.1310 39.5860 38.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
16.7960 40.1220 37.1370 N 0 0 0 0 0 0 0 0 0 0 0 0
22.3560 41.5840 37.4860 H 0 0 0 0 0 0 0 0 0 0 0 0
23.6400 41.4990 38.4220 H 0 0 0 0 0 0 0 0 0 0 0 0
22.1830 41.4660 39.0630 H 0 0 0 0 0 0 0 0 0 0 0 0
24.5240 39.4120 39.0390 H 0 0 0 0 0 0 0 0 0 0 0 0
21.9880 35.0870 37.4060 H 0 0 0 0 0 0 0 0 0 0 0 0
22.6490 35.0140 38.8440 H 0 0 0 0 0 0 0 0 0 0 0 0
26.8030 31.4510 36.0280 H 0 0 0 0 0 0 0 0 0 0 0 0
27.1680 29.7900 34.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
25.9200 29.7690 32.4660 H 0 0 0 0 0 0 0 0 0 0 0 0
18.9760 40.9720 35.0680 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2220 41.3950 35.6240 H 0 0 0 0 0 0 0 0 0 0 0 0
13.1280 40.4840 37.4580 H 0 0 0 0 0 0 0 0 0 0 0 0
24.5550 37.1010 38.9060 H 0 0 0 0 0 0 0 0 0 0 0 0
24.7420 35.0860 37.6990 H 0 0 0 0 0 0 0 0 0 0 0 0
25.7640 33.4700 36.5970 H 0 0 0 0 0 0 0 0 0 0 0 0
23.9500 33.0460 33.6520 H 0 0 0 0 0 0 0 0 0 0 0 0
20.9300 37.1540 37.1700 H 0 0 0 0 0 0 0 0 0 0 0 0
20.6450 40.2890 36.5160 H 0 0 0 0 0 0 0 0 0 0 0 0
14.3400 39.3520 39.0860 H 0 0 0 0 0 0 0 0 0 0 0 0
16.6170 39.1240 38.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
1 33 1 0 0 0 0
1 34 1 0 0 0 0
2 1 1 0 0 0 0
2 3 1 0 0 0 0
3 35 1 0 0 0 0
4 20 1 0 0 0 0
5 4 1 0 0 0 0
5 37 1 0 0 0 0
6 21 1 0 0 0 0
7 6 2 0 0 0 0
8 9 1 0 0 0 0
8 22 1 0 0 0 0
9 38 1 0 0 0 0
10 39 1 0 0 0 0
10 9 2 0 0 0 0
11 10 1 0 0 0 0
12 11 2 0 0 0 0
12 24 1 0 0 0 0
13 2 2 0 0 0 0
14 27 2 0 0 0 0
15 31 1 0 0 0 0
15 14 1 0 0 0 0
16 15 2 0 0 0 0
17 18 1 0 0 0 0
17 31 1 0 0 0 0
18 19 2 0 0 0 0
19 43 1 0 0 0 0
19 29 1 0 0 0 0
20 3 2 0 0 0 0
20 44 1 0 0 0 0
21 45 1 0 0 0 0
21 5 1 0 0 0 0
22 6 1 0 0 0 0
22 46 1 0 0 0 0
23 12 1 0 0 0 0
24 8 2 0 0 0 0
25 13 1 0 0 0 0
25 4 2 0 0 0 0
26 14 1 0 0 0 0
26 13 1 0 0 0 0
28 16 1 0 0 0 0
28 17 2 0 0 0 0
29 50 1 0 0 0 0
30 29 2 0 0 0 0
30 51 1 0 0 0 0
31 30 1 0 0 0 0
32 1 1 0 0 0 0
36 5 1 0 0 0 0
40 11 1 0 0 0 0
41 16 1 0 0 0 0
42 18 1 0 0 0 0
47 24 1 0 0 0 0
48 25 1 0 0 0 0
49 26 1 0 0 0 0
M END
$$$$