SIAL-ZINC02547582 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 32 0 0 1 0 0 0 0 0999 V2000 -0.1260 1.5850 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 0.2280 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 -0.4500 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 -0.0070 1.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -1.5940 -0.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0560 -2.4660 -0.1860 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8840 -1.8720 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -3.6720 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -3.3120 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 -4.5580 3.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -5.2920 3.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -3.0780 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -3.2750 -2.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 2.3340 0.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0350 2.4340 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 3.7500 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 3.8340 1.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 2.2020 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 1.4480 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 0.3610 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.4510 0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -1.9080 -1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -4.4450 0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -4.1340 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -2.5290 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -2.9340 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -4.6820 3.2240 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7060 -3.2760 -1.7230 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3410 4.5530 0.6890 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3590 1.5660 0.3540 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8160 1.1780 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2700 0.8810 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 2.3720 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 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 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M CHG 1 29 -1 M CHG 1 30 1 M END