IFLAB-ZINC04315796 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2090 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0170 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3960 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 4.3670 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 5.6400 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 5.6780 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 4.4010 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2060 4.1300 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 7.1390 0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 8.3960 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 9.7880 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 10.8060 0.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 12.1140 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 12.4480 0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 13.1400 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 14.4960 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 15.4490 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 15.0650 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 13.7220 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 12.7590 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 16.2710 0.1120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.4190 -0.0220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -0.5180 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.9410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 4.0340 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 8.2830 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 8.2750 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 9.9010 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 9.9090 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 10.5390 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 14.7970 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 16.4980 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 13.4280 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 11.7120 0.0630 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 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 31 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 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 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 M END