IBS-ZINC02139050 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8500 -0.5680 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -0.3420 2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -1.1100 2.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9780 -2.1690 2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -0.9280 3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.6970 4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -1.5730 6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -0.6720 6.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 0.0920 5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -0.0380 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 0.8120 2.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 0.8720 1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0590 -0.5630 1.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9610 -1.1730 1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -0.5980 0.0450 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0480 -0.0650 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -2.0380 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -1.8800 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.5710 -1.3160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6580 -0.7750 -1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 0.3730 -2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 0.3770 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -0.3830 -3.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 1.3290 -4.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 1.1300 -5.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 2.0830 -6.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 2.8420 -6.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -0.5400 7.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.9040 -0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 1.8840 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 1.8800 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.6380 0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.0720 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -0.7060 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.7220 2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -2.3980 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -2.1750 6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 0.7940 5.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 0.3850 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 1.8210 3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 1.3380 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 1.4500 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -2.6750 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -2.4400 -0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -2.7230 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -1.8180 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 1.1340 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.3550 -4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 1.3260 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 0.1050 -5.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 0.1270 8.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0930 2.0870 -7.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 2.7150 -8.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 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 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 30 53 1 0 0 0 0 54 55 1 0 0 0 0 M END