IBS-ZINC02694868 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -0.6540 -1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -2.0030 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -0.9230 1.4460 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -1.8510 1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.2110 2.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 0.5200 2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 0.7800 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 1.9000 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 2.8050 3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 2.5310 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 1.3860 2.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 3.8180 4.4240 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 4.6190 4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 3.9450 3.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 5.8060 4.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3890 6.3350 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 5.7710 4.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 7.6020 5.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 8.1630 5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 9.3500 6.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 9.9400 6.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 9.3890 6.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 8.2570 6.2950 C 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -0.6040 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 0.1500 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.0540 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -2.8070 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -2.1100 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 0.0950 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 2.0900 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 1.1800 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4970 6.2560 5.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7610 7.6810 4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2510 9.8120 5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4980 10.8670 7.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 7.8340 6.4170 H 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 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 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 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 M END