./SDF_3D/D08050_m0.pdb
OpenBabel10082115403D
49 50 0 0 1 0 0 0 0 0999 V2000
1.2220 9.0840 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0660 9.5310 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7290 8.6470 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3960 7.3060 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7670 6.8170 -0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5700 7.7370 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1980 6.5310 -1.8710 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8520 5.2410 -2.0270 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2580 4.6600 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0730 5.4290 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3780 11.1890 -0.1710 Cl 0 0 0 0 0 0 0 0 0 0 0 0
2.2200 4.9080 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5900 3.4860 -0.0520 C 0 0 1 0 0 0 0 0 0 0 0 0
3.4240 3.2450 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3920 3.1530 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9320 1.8120 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8390 0.7300 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7430 0.9810 -2.5430 N 0 0 0 0 0 0 0 0 0 0 0 0
2.2650 0.9320 -3.9320 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2830 1.4100 -5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9520 1.4500 -6.2740 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6610 -0.0120 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0990 0.1330 -1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8570 9.7690 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6270 9.0080 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4940 7.4130 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5160 4.6580 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4530 3.6130 -1.6450 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3380 5.3100 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6960 2.8550 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2970 3.9130 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8480 3.5450 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3310 3.7170 1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6290 2.0860 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8200 3.4060 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6330 1.5560 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5340 1.7820 -2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4340 0.6570 -0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3120 -0.2380 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6200 -0.0770 -4.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1420 1.5810 -4.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9190 2.4170 -4.7860 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4300 0.7340 -5.1200 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3250 1.8270 -6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0470 -1.0350 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0900 0.1170 -3.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5010 -0.1720 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9890 -0.5050 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4320 1.1650 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 6 1 0 0 0 0
1 24 1 0 0 0 0
2 3 1 0 0 0 0
2 11 1 0 0 0 0
3 4 2 0 0 0 0
3 25 1 0 0 0 0
4 5 1 0 0 0 0
4 7 1 0 0 0 0
5 6 2 0 0 0 0
5 10 1 0 0 0 0
6 26 1 0 0 0 0
7 8 2 0 0 0 0
8 9 1 0 0 0 0
8 27 1 0 0 0 0
9 10 2 0 0 0 0
9 28 1 0 0 0 0
10 12 1 0 0 0 0
12 13 1 0 0 0 0
12 29 1 0 0 0 0
13 14 1 0 0 0 0
13 15 1 0 0 0 0
13 30 1 6 0 0 0
14 16 1 0 0 0 0
14 31 1 0 0 0 0
14 32 1 0 0 0 0
15 33 1 0 0 0 0
15 34 1 0 0 0 0
15 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 18 1 0 0 0 0
17 38 1 0 0 0 0
17 39 1 0 0 0 0
18 19 1 0 0 0 0
18 22 1 0 0 0 0
19 20 1 0 0 0 0
19 40 1 0 0 0 0
19 41 1 0 0 0 0
20 21 1 0 0 0 0
20 42 1 0 0 0 0
20 43 1 0 0 0 0
21 44 1 0 0 0 0
22 23 1 0 0 0 0
22 45 1 0 0 0 0
22 46 1 0 0 0 0
23 47 1 0 0 0 0
23 48 1 0 0 0 0
23 49 1 0 0 0 0
M END
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OpenBabel09102109563D
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GENERATED BY OPEN BABEL 2.4.1
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0 0 0 0 0 0 0 0 49 0 49 0
$$$$