NCID-ZINC04962373 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.0290 1.2510 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -0.1360 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -0.7100 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 0.1070 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 1.4930 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 2.0810 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 3.5780 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 4.1030 1.6200 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 5.9110 1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 6.7100 2.6600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3220 6.4870 3.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 8.1960 2.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 8.7640 1.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 8.8000 2.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 10.1730 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 10.5180 1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 9.6420 2.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 6.4570 3.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2990 6.4790 4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 6.7100 5.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 6.2190 5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4790 6.1360 7.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8120 5.9620 7.8010 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4000 5.1350 7.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 5.7670 9.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 6.6820 9.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -2.1300 -0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -3.2810 -0.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 1.6800 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -0.7580 0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -0.3250 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1540 2.1120 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 4.0710 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 3.9080 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 6.1610 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 6.1720 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 8.3360 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 10.8440 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 10.2900 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 6.2950 3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 5.2810 5.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3060 7.0310 5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 7.0310 7.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 5.2930 7.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 11.6070 1.3920 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9650 4.8250 9.7640 O 0 5 0 0 0 0 0 0 0 0 0 0 5.6540 7.2130 7.6320 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8530 7.3930 8.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 8.0430 7.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 7.0700 7.1710 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 27 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 47 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 27 28 3 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 47 50 1 0 0 0 0 M CHG 1 45 -1 M CHG 1 46 -1 M CHG 1 47 1 M END