IBS-ZINC02105627 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.9660 0.8020 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.5310 -1.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -0.8660 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 0.0030 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.4000 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 1.7680 -1.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 2.3960 0.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 3.7610 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 4.5650 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1960 4.3280 -1.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 3.3740 -1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 2.1360 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 1.9540 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2220 0.7410 3.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2960 0.1380 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -0.7130 0.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -1.9790 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -2.1270 -0.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -3.3910 -0.9640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1960 -3.1690 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -4.2860 0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4250 -4.2350 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -5.6810 -0.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1320 -6.4850 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 -5.5390 -0.9970 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3870 -5.7180 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -4.1530 -1.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 -6.4280 -2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 -6.3250 -2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -5.3660 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3780 -5.9530 -1.6410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -5.3540 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 -4.0790 -0.1060 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3180 1.1550 -2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 3.7400 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 4.2800 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 5.6350 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 4.3320 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 1.2830 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8830 2.9990 1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 1.9450 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 2.7800 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -2.8290 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -7.4780 -1.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -6.1240 -3.0920 H 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 34 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 33 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 31 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 33 -1 M END