OTAVA-ZINC01236282 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.3830 0.5660 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 0.1890 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -0.1410 -1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -0.0900 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 0.2840 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 0.6160 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -0.4850 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 0.2790 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 1.7610 -0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 2.9300 -0.8010 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 2.0540 -0.3810 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2490 0.9980 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4530 1.0390 -0.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -0.4920 -0.6460 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9140 3.3950 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9210 3.6980 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 3.0010 2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6510 4.8330 1.6350 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8970 5.4570 2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3880 4.9800 4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 5.6470 5.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4660 6.7920 5.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 7.2770 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7030 6.6210 2.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2680 7.1560 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9510 6.4990 0.5040 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4390 0.8210 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 0.1490 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9900 -0.4380 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 0.3250 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.9130 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -1.5680 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 3.4380 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 4.1630 -0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1190 5.3530 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 4.0920 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2750 5.2690 6.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6870 7.3090 6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5960 8.1740 4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9970 8.1930 1.6050 O 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 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 40 2 0 0 0 0 M CHG 1 26 -1 M END