IFLAB-ZINC04101417 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 0.5300 -0.9960 1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.2020 0.0680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2150 0.8580 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.5590 -1.2520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8480 -0.1750 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -2.0610 -1.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -2.8430 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -4.2190 -1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -4.4510 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -3.0170 -1.7940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.2320 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 0.5340 -4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 2.4350 -3.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 1.7250 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4430 2.6920 -5.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 -0.4170 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 0.4790 0.7980 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6940 -0.3680 0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 1.1040 1.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 1.7410 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 1.4050 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2290 2.3970 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7950 3.7110 -2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9770 4.0450 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5830 3.0580 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 4.9280 -3.2650 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.0560 1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6180 -0.9180 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.6150 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 -2.4530 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -5.0020 -1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -5.3980 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -1.2980 -3.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -0.0560 -3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 0.2080 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 0.2570 -4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 2.2560 -3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 3.5130 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 1.9390 -2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 2.0480 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 2.5000 -5.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 2.3880 -6.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 3.7730 -5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -1.4000 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 0.3860 -1.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8760 2.1420 -3.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 5.0720 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 3.3290 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 0.2110 -2.4480 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.0060 -2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 1.9890 -4.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 49 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 49 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 51 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 49 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END