IBS-ZINC02216136 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 0 0 0 0 0 0 0 0 0 0 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8080 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.3220 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -3.6780 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -4.5460 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -4.0230 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6650 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -6.0000 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -6.4500 -2.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -6.9310 -0.8070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5640 -6.4520 0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -7.2590 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -8.1670 -0.7720 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4880 -9.0010 -1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -10.0280 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -9.7810 -0.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -8.6220 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -8.2820 1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -9.1750 2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3000 -10.3440 1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7230 -11.1840 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -11.2460 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -12.3270 -4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 -13.3490 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -13.2940 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -12.2160 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -14.5270 -4.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -1.6520 -3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -4.0770 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -4.6880 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 -2.2610 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -7.9330 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -6.3400 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -7.7390 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -8.8790 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -7.2290 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -8.5250 2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -8.6460 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3930 -9.5320 3.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -11.1600 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -10.6980 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -10.4490 -4.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6250 -12.3760 -5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -14.0950 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 -12.1720 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -14.3220 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0680 -15.4140 -3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -14.6970 -5.3320 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 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 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 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 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 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M CHG 1 15 1 M END