IFLAB-ZINC04292085 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -1.9130 0.3020 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -0.3460 0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7330 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.4220 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -1.8870 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -1.6580 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.9680 3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 -0.5050 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -2.1960 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -1.4940 5.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9800 -2.1610 6.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -3.3760 6.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5950 -1.2170 7.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 0.1030 6.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 1.0860 7.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2710 0.2140 5.4960 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 -1.6000 8.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8930 -1.7730 7.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 -0.6940 7.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1210 -0.8620 7.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5950 -2.1080 7.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6900 -3.1780 7.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3550 -3.0140 7.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0450 -2.2920 6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8060 -1.2780 6.7700 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7760 1.2550 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 0.5180 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -0.3490 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -1.6040 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -2.4290 1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.7910 4.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 0.0240 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -3.2840 4.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3930 -0.8390 9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0860 -2.5360 8.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 0.2860 8.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8030 -0.0140 7.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0320 -4.1530 6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 -3.8660 7.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3950 -3.4490 6.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 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 24 25 1 0 0 0 0 24 40 2 0 0 0 0 M CHG 1 25 -1 M END