IFLAB-ZINC02966291 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 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 1.0790 -3.1200 -3.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.8510 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4050 -2.8440 -3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -4.1220 -4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -4.0750 -5.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -3.7760 -4.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6300 -4.1320 -4.2100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1910 -3.2070 -3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -5.5800 -3.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -6.2000 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -7.5280 -2.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -8.2420 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -7.6170 -3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -6.2830 -4.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -8.2970 -4.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 -9.7260 -4.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6050 -10.1290 -3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3140 -9.5510 -2.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -3.8470 -5.4740 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 2.5550 -1.8830 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8260 -3.6360 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -1.9760 -4.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4490 -2.7980 -3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9190 -4.1980 -5.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -4.9880 -3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -3.2960 -6.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -5.0400 -5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -3.7580 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -2.3560 -3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -5.6460 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -8.0100 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -5.7950 -4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 -10.1460 -4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -10.0940 -5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 -9.7560 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -11.2150 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -4.0650 -5.5190 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 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M CHG 1 8 1 M END