SIAL-ZINC00045280 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 0 0 0 0 0 0999 V2000 -0.4750 1.7850 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.4780 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 0.1370 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -0.6050 -0.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -1.6880 -1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -1.8210 -2.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -2.6630 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 -3.6640 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -3.8780 -2.6980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -4.5720 -0.8910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -5.4180 -1.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -5.3170 -2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7130 -6.2060 -3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2730 -7.2070 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 -7.3100 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -6.4200 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -6.5150 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8980 -5.5840 1.2600 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2070 2.6130 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 2.0330 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 1.7160 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 0.5950 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 0.9390 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -0.0160 1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -0.7850 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -0.5540 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -2.5470 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -4.8340 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 -4.7030 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -4.5260 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -6.1100 -4.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 -7.8990 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -8.0830 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 -7.4850 1.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 34 2 0 0 0 0 M CHG 1 18 -1 M END