IBS-ZINC04085189 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 0 0 1 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -0.0480 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -0.8430 2.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -2.6650 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -2.0520 -2.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -4.1720 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -4.5500 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -4.6720 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -6.2020 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -6.7000 -1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -6.3220 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -6.2000 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -4.6700 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -8.2300 -1.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -8.7060 -1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -10.0280 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -10.8250 -1.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -10.5180 -0.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6290 -10.1400 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 -10.0160 1.1160 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 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -2.4890 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 -4.3170 -3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -4.2940 -3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -6.5800 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -6.5580 -3.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -6.5780 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -6.5550 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -4.2920 -0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -4.3130 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -8.6080 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -8.5880 -2.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -8.0690 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -10.3940 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -10.3700 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7410 -8.9260 1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -12.3440 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2770 1.2690 1.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -11.9870 -0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5940 -12.3400 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 1.5330 2.2820 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 4 1 0 0 0 0 2 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 49 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 50 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 48 50 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END