IFLAB-ZINC02974524 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7780 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0810 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7650 -2.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1140 -3.1240 -3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -2.7290 -2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -3.9510 -2.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -4.8480 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -4.0490 -4.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -4.3010 -5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -3.7760 -4.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -3.9000 -4.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1920 -3.1980 -3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -5.3480 -4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3440 -6.2870 -3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -7.6160 -3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 -8.0110 -4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 -7.0670 -5.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 -5.7340 -5.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -7.4320 -5.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -8.8250 -6.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -9.6260 -4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -9.3240 -4.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -3.2290 -5.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2850 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1620 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6220 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -2.1280 -3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -2.1280 -1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -3.6330 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -4.4950 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3110 -5.3740 -3.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 -5.5820 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 -2.9880 -4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -4.4030 -5.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -3.8270 -6.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -5.3750 -5.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -3.8950 -2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -2.3390 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -5.9810 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -8.3470 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -4.9980 -5.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7880 -9.0280 -6.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -9.1040 -6.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -9.3420 -4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -10.6920 -5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -3.2820 -5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -4.6620 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -4.6430 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -4.6390 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 17 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M CHG 1 8 1 M END