NCID-ZINC04962355 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 2.1680 -0.0220 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7120 1.5740 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 3.3860 -0.0160 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2290 -2.1860 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.7820 -1.7340 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -4.5850 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -5.2480 -2.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1220 -4.9300 -3.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -6.7460 -2.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -7.4180 -3.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -7.3390 -2.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -8.7960 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 -9.2010 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -8.3600 -0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -4.8540 -3.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -4.8710 -4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -5.2120 -5.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -4.4650 -5.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -4.5730 -7.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -4.1610 -8.0050 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0750 -4.7600 -7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -4.3830 -9.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -3.4530 -10.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4980 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -2.5390 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.5630 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 -4.8790 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -4.9030 -0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -6.8020 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -9.1130 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -9.2680 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -4.5800 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 -5.1230 -5.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -3.4360 -5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -3.9140 -7.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -5.6020 -7.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -2.5750 -6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7870 -10.4970 -0.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -5.6150 -9.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -2.7390 -7.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -2.1620 -8.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -5.7080 -10.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -10.7090 -0.4600 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 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 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 21 22 1 0 0 0 0 21 41 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 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 49 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 46 49 1 0 0 0 0 47 52 1 0 0 0 0 48 51 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END