IFLAB-ZINC04519404 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.8790 -0.6050 1.4720 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -0.2900 1.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -0.3250 2.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -2.2550 1.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.9220 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 -4.4170 0.5360 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6450 -4.8450 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 -5.1040 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -6.0920 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -6.4360 -2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9120 -5.6380 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 -4.8290 -1.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -4.6520 2.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -4.1720 1.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -4.2900 3.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -6.3990 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -7.0270 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -8.3980 1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -9.1410 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 -8.5120 2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -7.1410 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 -10.8620 2.5720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -2.7790 1.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.7810 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -2.4950 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -6.5370 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -7.1950 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -5.6440 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 -6.4470 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -8.8880 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -9.0920 3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 -6.6490 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 M END