IBS-ZINC04011371 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.8030 1.4730 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 0.0470 0.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0980 -0.6560 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -0.2600 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 0.4750 1.3830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7890 1.5590 1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 0.1810 0.0940 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9870 -0.8860 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 0.4940 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.1510 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 0.9650 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -0.0080 2.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 0.5460 3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 1.4410 3.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -0.1730 4.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 0.6640 6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 1.1210 6.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0370 1.8960 7.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 2.2260 8.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6950 1.7820 8.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 1.0080 6.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -1.5740 5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6560 -2.6280 5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -3.9230 5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -4.1810 5.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -3.1440 5.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 -1.8480 5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 2.2310 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 1.6340 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 1.6590 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.0210 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -1.3420 1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 1.5610 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.1560 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 0.9030 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -0.7080 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.6000 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 0.7030 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 0.7430 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8560 2.0440 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -0.2980 4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6440 0.8780 5.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 2.2440 7.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 2.8300 9.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 2.0410 8.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 0.6860 6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 -2.4500 5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 -4.7310 5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -5.1890 5.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -3.3440 5.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -1.0590 5.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -0.2560 -1.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8240 -1.2540 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 52 1 0 0 0 0 4 5 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 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 52 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 52 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END