SIAL-ZINC04544496 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.1550 -0.6490 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2900 0.0270 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 1.4110 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 2.0560 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 2.1820 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6650 2.7360 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 3.1600 -1.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7910 3.9070 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 3.8530 -1.2800 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7120 3.1050 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 4.8300 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 5.3910 -2.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 4.5670 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 2.4460 -2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 1.2730 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -1.7410 -1.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4820 -2.4350 -1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -2.5240 -1.1670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4700 -1.8300 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -3.4890 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 -4.1360 -2.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -3.2630 0.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -1.0010 -2.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 -1.5150 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -0.5000 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 4.3020 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 5.6280 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3190 6.0220 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5210 5.2500 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 1.7630 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 0.7450 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 -2.9350 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -4.2380 -2.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0220 -4.7640 -3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -3.9020 0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -0.3630 -2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -2.1530 1.3650 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 18 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 M END