IFLAB-ZINC05240772 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 2.7150 0.2440 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -0.7840 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -2.4630 1.1560 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -3.4220 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -4.1330 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -4.8860 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -4.9350 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -4.2430 2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -3.5040 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -2.8480 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.0870 4.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -3.2430 4.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -2.8160 5.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -3.3100 5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -2.5740 6.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 -1.6350 7.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 -1.5970 6.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -0.6910 8.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -1.4740 8.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 -2.7100 7.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 -0.0480 10.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -4.4060 5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 -4.6850 3.8830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 -5.1660 5.6840 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 0.1160 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 1.2530 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 0.1880 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -0.6080 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.6880 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -4.1020 -0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -5.4300 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -5.5160 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -4.2890 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -3.9230 3.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 0.3220 8.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7710 -0.6820 9.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 -1.6910 9.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2760 -0.6020 7.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6550 -3.5910 8.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 -2.8620 6.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 0.1430 10.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4970 0.8570 9.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 -0.4420 11.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 -5.0540 6.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -5.9100 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 -1.0940 9.3570 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5470 -1.9360 9.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 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 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 46 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END