SIAL-ZINC04535674 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.2400 0.4570 -1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.7710 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.3860 0.4910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6690 0.6920 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -1.0120 1.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -2.0830 0.3050 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9060 -3.0620 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -1.4590 -1.4030 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6020 -1.7560 1.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9560 -2.6080 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.8440 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.1580 2.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7080 -1.0290 0.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -1.5070 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3370 -2.6210 0.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9580 -0.5970 -0.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8820 -0.6190 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2470 -1.1150 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5350 -1.5630 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8120 -2.0510 -3.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 -2.1000 -4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5210 -1.6580 -4.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -1.1690 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 0.8750 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 1.0820 -0.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -0.7040 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -1.7970 1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -1.8780 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 1.2360 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 0.2020 -2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 0.8960 -1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 -0.0670 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3330 -1.5310 -1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8140 -2.3910 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0200 -2.4780 -5.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 -1.6920 -4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2370 -0.8230 -2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -2.1700 -2.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.7790 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -1.5410 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4700 1.7170 -0.4670 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7250 0.1630 1.0750 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 26 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 M CHG 1 41 -1 M CHG 1 42 -1 M END