IFLAB-ZINC04063474 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -0.6500 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.1200 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.4360 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.1310 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -2.7890 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -4.5190 -0.0410 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.1810 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -2.8980 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -5.1390 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -6.4490 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -6.7920 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3260 -7.4630 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -7.1410 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -8.2160 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 -9.6800 -0.0190 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -8.8040 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -9.5220 -0.0600 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 -8.1780 0.0140 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9130 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 -0.3660 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.1530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -2.3360 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -4.8660 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1150 -6.1300 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 M END