IBS-ZINC00217452 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -1.9930 0.7140 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -0.0700 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 0.1500 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -0.9910 0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 -1.3680 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -2.5800 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -3.4200 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 -3.0760 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.8600 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -1.2820 -0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -1.6990 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 1.2920 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 1.4240 2.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 2.3170 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 1.6800 3.4410 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 3.2030 3.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4740 3.6490 3.3510 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 3.9250 4.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7130 5.2190 5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 5.1560 7.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 3.3930 7.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 3.4970 5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 4.6710 9.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 1.6900 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6620 0.2050 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 0.8560 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -0.7240 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 -2.8640 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -4.3580 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -3.7330 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 3.2210 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 2.6120 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 5.9700 5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 5.5480 5.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 6.1410 7.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 4.4270 7.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 2.6260 7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 3.1800 7.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 2.5440 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7820 4.2520 5.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 3.9220 9.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 5.6650 9.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 4.4100 9.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 4.7170 7.6550 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1580 5.4290 7.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 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 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 44 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END