IFLAB-ZINC04387742 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.1250 1.5170 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.0350 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -0.4850 -3.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.5970 -1.5870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -1.9730 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -2.9210 -2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6610 -4.2700 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -4.6770 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -3.7460 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.3980 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -6.3810 -0.1630 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -6.4790 1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -6.8560 -0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -7.0900 -0.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -7.1800 0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9380 -6.5850 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -6.8010 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -5.3100 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -4.4750 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9730 -3.0980 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -2.5490 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -3.3660 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -4.7420 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 -0.8490 -1.6620 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -8.6940 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -9.4440 -0.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.9540 -1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 1.6910 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 2.0000 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -0.0140 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -2.6450 -3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -4.9920 -2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -4.0520 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -1.6880 0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -8.0650 -1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1770 -7.1390 -0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -7.3180 -1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -4.8970 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 -2.4660 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -2.9410 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -5.3710 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -8.9840 1.2740 O 0 5 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 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 40 1 0 0 0 0 23 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 42 -1 M END