CHEMSTAR-ZINC04018284 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.5500 -0.3560 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -1.7780 0.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -2.1910 0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -1.3900 0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 -3.6530 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8280 -3.9970 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -4.4560 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -5.9280 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -6.6500 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -8.0010 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -8.6280 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -7.9060 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -6.5570 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -3.8440 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -3.6820 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -3.3790 -2.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8820 -3.8780 -1.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3570 -3.1730 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2190 -5.3080 -0.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -6.2320 -1.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -3.6470 -2.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -3.2540 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5830 -3.2000 -1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8920 -2.8120 -1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3220 -2.4760 -3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4430 -2.5280 -4.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -2.9100 -4.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 -2.9600 -5.1790 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0300 -2.6210 -5.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5750 -3.3390 -6.2700 O 0 5 0 0 0 0 0 0 0 0 0 0 -10.7250 -2.0600 -3.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.5000 -2.0140 -2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.1050 -1.7650 -4.5110 O 0 5 0 0 0 0 0 0 0 0 0 0 1.6210 -0.1580 0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 0.1930 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -0.0350 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -4.2450 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -4.1750 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -6.1600 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -8.5650 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -9.6830 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -8.3960 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -5.9930 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -4.0860 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 -5.4520 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -5.4770 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -7.1600 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -3.7670 -3.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 -3.4630 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5810 -2.7700 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7820 -2.2660 -5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 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 15 16 2 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 17 21 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 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M CHG 1 31 1 M CHG 1 33 -1 M END