IBS-ZINC04859758 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 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 -0.7000 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0690 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6880 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.8130 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1720 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -4.9480 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -4.5910 -0.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -6.2800 0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3570 -6.2030 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -7.6820 0.1700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5250 -7.8610 -0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -9.2420 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -9.3890 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -8.0500 -0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 -6.3040 -0.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7510 -6.4440 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -4.9130 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -4.5270 0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -8.0500 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -8.0740 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1690 -8.4120 2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -8.7240 3.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2750 -8.6990 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -8.3680 2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -9.1470 4.7020 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8400 2.4940 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 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -3.0060 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -2.2110 -3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -3.7590 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -8.7450 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -10.2130 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -10.1750 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 -9.5840 -1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3180 -8.1570 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -7.4200 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 -7.8300 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 -8.4300 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -8.9440 4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -8.3520 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.0360 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -3.7850 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -2.2470 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -8.4340 0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -7.4710 0.2800 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 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 36 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 21 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 19 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 14 52 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 53 1 0 0 0 0 21 22 2 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 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 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 47 1 0 0 0 0 28 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 M END