IBS-ZINC05298452 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -3.8510 -1.1210 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -2.1850 2.0250 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -1.1980 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -1.8800 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 -1.0510 2.8420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3470 -0.0280 2.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -1.7270 2.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -2.9210 2.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -1.0680 4.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 -0.1100 5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 1.2410 5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 1.7470 4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 3.0870 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 3.9500 5.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 3.4610 5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 2.1270 5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0850 0.4670 6.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 -0.5120 5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -1.8340 5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 -2.1780 6.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -1.2050 7.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2360 0.1030 7.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -0.1300 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 -1.5630 2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -1.0290 3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -0.2090 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -1.0830 3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 -2.8760 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -2.0330 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -1.8620 4.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 1.0850 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 3.4490 4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 4.9980 5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 4.1410 6.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 -2.6080 5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4200 -3.1980 6.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6270 -1.4560 7.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 0.8630 7.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -1.0020 1.3800 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6940 1.7460 6.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 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 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 40 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 M CHG 1 39 -1 M END