IFLAB-ZINC00135385 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 0 0 0 0 0 0999 V2000 0.0660 1.1140 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.3680 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.2120 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -0.8570 -1.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -0.6460 -1.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 0.3820 -2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 0.2540 -2.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -0.8850 -1.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -1.4220 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -2.8820 -0.4330 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -3.3320 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -4.6150 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2660 -5.6920 0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 1.4650 -3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 1.2170 -4.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 2.2710 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 3.6040 -4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 3.8350 -3.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 2.7840 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 4.7850 -5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 5.7500 -5.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 5.5440 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 4.3670 -6.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 1.6490 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.4700 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 1.3840 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -0.8580 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -2.2840 0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.3500 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -1.9260 -1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -2.5440 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8970 -3.5080 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 0.2000 -4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 2.0160 -5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 4.8470 -3.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 3.0020 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 6.1850 -5.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 6.5850 -6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 5.2350 -6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 4.8780 -3.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 6.3700 -4.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5570 5.9770 -3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 3.8550 -7.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 5.2420 -6.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 3.7020 -6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -4.4540 2.0160 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 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 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 46 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 M CHG 1 46 -1 M END