NCID-ZINC01658944 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 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 0.7450 -0.5660 1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0320 -1.6000 1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -0.5090 2.4190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -0.5880 2.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1720 0.2060 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -0.6990 0.2980 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -1.9300 2.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7890 -2.7860 2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -1.6160 3.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -2.1710 3.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -1.9420 3.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 -3.0990 4.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -4.1300 3.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -3.1120 5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -4.4440 5.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4140 -4.6310 6.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 -5.8990 7.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -6.0870 8.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -5.0110 8.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6840 -3.7460 8.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -3.5550 7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1120 -5.2140 10.0440 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.5420 -6.3280 10.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4560 -4.2680 10.7290 O 0 5 0 0 0 0 0 0 0 0 0 0 1.9800 0.2580 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 1.1100 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.5410 -1.2970 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 -2.7790 -1.1180 4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -2.7540 6.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 -2.4610 5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6010 -6.7390 6.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1640 -7.0740 8.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9900 -2.9080 9.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4180 -2.5670 7.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -0.1890 -1.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.6310 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -0.1860 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0920 0.0440 0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 0.5970 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 27 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 29 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END