NCID-ZINC04962381 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 0.1140 0.8610 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.5100 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -1.0200 -0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 -0.1570 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 1.2190 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 1.7250 0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -0.7450 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -1.8280 -1.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2060 0.0500 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 -1.0600 -0.1170 S 0 0 0 0 0 0 0 0 0 0 0 0 7.9770 0.1550 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3740 -0.4630 -0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4550 -0.9950 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3850 0.6910 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8770 1.0940 -1.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6240 1.2700 1.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5090 2.4190 1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5340 2.9030 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8180 2.2110 3.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7550 -1.3540 -1.1610 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7980 -2.7270 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5120 -3.3520 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2480 -3.3980 -2.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4870 -4.9010 -2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0420 -5.5620 -3.4170 C 0 0 3 0 0 0 0 0 0 0 0 0 11.9320 -5.0440 -3.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3850 -7.0660 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8000 -7.7060 -4.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 1.2580 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -1.1840 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -2.0930 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 1.9240 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 2.7950 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 0.7140 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 0.6340 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 0.6440 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 0.9210 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2060 0.9430 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5160 2.1240 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1640 3.2270 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -0.9030 -2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4760 -3.2160 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1720 -2.9130 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1910 -5.0550 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5550 -5.3940 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2460 3.9200 3.0100 O 0 5 0 0 0 0 0 0 0 0 0 0 12.1290 -7.4230 -2.3130 O 0 5 0 0 0 0 0 0 0 0 0 0 10.0220 -5.4990 -4.5390 N 0 3 0 0 0 0 0 0 0 0 0 0 10.3060 -4.9360 -5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 -5.3280 -4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0600 -6.5310 -4.8340 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 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 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 48 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 46 -1 M CHG 1 47 -1 M CHG 1 48 1 M END