IBS-ZINC02133330 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.4430 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.0490 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 -0.6570 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 0.0410 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 1.4290 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 2.1380 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6830 2.1340 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 3.3630 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 1.3380 -0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -0.0510 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 -0.7460 -0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -0.6540 -0.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 -1.6650 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1190 2.0170 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5290 2.2580 1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 1.8990 2.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7320 2.9150 1.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6070 3.4580 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3830 4.5390 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 3.9530 2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 3.1480 2.9330 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5480 3.7310 3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7030 1.8890 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1560 0.9190 3.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 1.9890 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -0.4900 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -1.7420 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 3.2240 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8920 1.4150 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 2.9800 -0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2640 2.6510 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0510 3.8520 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3300 4.7840 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7830 5.4550 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4650 3.3190 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7120 4.7340 3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5920 2.0060 4.9920 O 0 5 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 M CHG 1 37 -1 M END