IFLAB-ZINC05251063 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.2020 1.4050 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 0.0300 0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -0.6200 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 0.0820 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 1.4560 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 2.1340 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 3.6220 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 3.9580 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 5.3890 1.8640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 6.2340 2.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 5.9320 3.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 7.6910 2.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 7.9680 1.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 8.5030 3.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 9.8910 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 10.5120 4.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 11.8910 4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 12.6640 3.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 12.0470 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 10.6660 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 14.1170 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 14.5800 5.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 14.9240 3.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -2.4060 -0.2790 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -2.8100 -0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -2.8790 1.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -2.5770 -1.3810 N 0 5 0 0 0 0 0 0 0 0 0 0 -0.5310 -2.1650 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 1.9060 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -0.5260 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -0.4310 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 1.9950 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 4.0840 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 4.0700 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 3.5850 2.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 3.4920 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9390 5.8010 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 8.0190 3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 9.9350 4.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 12.3570 4.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8190 12.6090 2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 10.2250 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 14.5940 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 15.9200 3.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 1 27 -1 M END