PUBCHEM-ZINC05974171 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 0.0900 1.3820 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -0.0160 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -0.7230 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 0.0130 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.4160 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 2.1200 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5870 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 4.4340 0.1010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 4.1510 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7980 5.7320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 6.9600 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 8.1240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 8.0200 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 6.7730 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 5.6140 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 4.2970 -0.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 9.4510 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 10.3250 0.9760 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9330 10.0760 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 11.2490 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.1910 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -3.0080 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -2.6990 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -4.3180 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6400 -5.5280 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8920 -6.7130 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -6.6460 -0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -5.4170 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -4.2370 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -2.9310 -0.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -8.0210 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -8.9200 0.8510 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2630 -8.7020 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -9.8330 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 1.8960 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -0.5550 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -0.4760 0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 1.9290 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5050 7.0070 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 8.9150 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 6.6970 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -5.5460 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0700 -7.5570 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -5.3700 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 9.7400 -0.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 9.0650 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 10.6390 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -8.2700 -0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 -7.5760 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -9.1560 -0.6760 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 30 2 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 31 32 2 0 0 0 0 31 48 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 18 1 M CHG 1 32 1 M END