IFLAB-ZINC05257908 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.4720 1.3350 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 0.6890 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 3.1180 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 3.5470 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 5.0480 2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 6.9330 3.5840 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5160 7.4890 3.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 7.3520 5.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 6.9050 6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 5.8670 5.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 7.7260 7.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 7.5830 8.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 6.5490 8.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 6.4820 9.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 7.4490 10.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 8.4830 10.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 8.5500 9.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 7.3820 11.8200 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 7.1610 2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 6.0580 2.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 0.3060 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 1.4460 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 2.0190 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 0.8350 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -0.3200 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 0.8560 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 3.7180 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 3.2170 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 3.2840 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 3.0170 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 5.3360 2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 5.6050 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 8.4420 5.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 6.9200 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 8.5270 7.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 5.7780 7.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 5.6790 9.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 9.2310 11.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 9.3680 9.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.6720 0.5470 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9360 1.5590 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 5.4440 3.5430 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9940 5.0360 3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 5.1590 4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 8.3290 2.3050 O 0 5 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 40 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 19 1 0 0 0 0 6 42 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 40 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M CHG 1 40 1 M CHG 1 42 1 M CHG 1 45 -1 M END