IBS-ZINC02138605 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 -0.1600 1.0150 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 1.5320 2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7680 2.5490 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 2.4500 3.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 2.9270 4.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 2.7960 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0030 2.1970 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4100 1.7100 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 1.8890 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 1.4110 1.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3950 0.3180 1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 1.9180 -0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 1.2200 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2600 -0.1400 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7380 -0.7930 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -0.0840 -3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7740 1.2710 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 1.9070 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5960 1.9910 -4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9390 1.2530 -5.2410 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.9440 -0.7330 -4.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 1.1190 1.6550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5450 -0.2080 2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3300 2.1580 4.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3370 2.8280 5.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 3.2080 5.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -0.0700 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.2930 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.2680 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 1.6910 2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 0.5050 2.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 2.3620 4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 3.5690 3.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 3.3830 5.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 2.9050 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -0.7270 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -1.8450 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 2.9620 -1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 -0.0200 -5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -0.7950 2.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -0.2040 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -0.6920 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9560 3.7300 5.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 2.1600 6.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 1.7480 1.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 3.2130 -4.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 45 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 46 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 20 -1 M END