NCID-ZINC05837687 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -0.1850 1.2380 2.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -0.1120 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -1.2600 3.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -2.4530 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -2.6600 1.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6800 -2.6440 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -4.0970 1.2970 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1610 -4.8740 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -3.7160 2.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -4.2760 3.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2670 -4.4000 0.8990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 -3.6380 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -5.6660 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 -6.6110 0.4020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 -5.7650 0.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7060 -4.9790 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -5.4780 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -6.4140 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -6.1280 -3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -4.8960 -4.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9900 -3.9510 -3.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 -4.2390 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 -4.5670 -5.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 -5.3260 -5.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 -7.1210 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6210 -8.5270 0.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1930 -9.3960 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 -11.0660 1.4860 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 -8.6450 2.8260 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -7.3570 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4970 -8.9670 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -8.9340 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 -8.1730 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -1.4740 0.2480 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -0.0300 0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -1.2240 4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.6420 5.2930 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6530 1.1850 3.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 1.8490 3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 1.7610 2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 -7.3750 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -6.8690 -4.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 -2.9910 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 -3.4840 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7610 -6.5950 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 -6.6590 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -7.6750 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 -6.4580 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 -10.0060 -0.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3760 -9.4080 -2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8150 -9.4700 -1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 -7.9110 -2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3140 -8.2070 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4830 -8.5950 -1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 -7.1210 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 0.0970 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 0.8420 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -7.0830 0.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -1.7350 4.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 34 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 10 2 0 0 0 0 11 12 1 0 0 0 0 11 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 17 1 0 0 0 0 15 58 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 58 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 35 56 1 0 0 0 0 35 57 1 0 0 0 0 36 37 1 0 0 0 0 36 59 2 0 0 0 0 M CHG 1 37 -1 M END