IFLAB-ZINC04331241 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.7950 -7.0350 4.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -6.2730 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -5.1410 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -4.4400 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -4.8750 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -6.0130 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -6.7120 2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1680 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -4.8500 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -4.1500 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -4.8710 -3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -6.1950 -3.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -6.8310 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -6.1780 -1.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -8.2260 -2.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -9.0350 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -10.3140 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -10.2910 -1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -9.0430 -1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -11.5260 -3.8790 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5450 -11.4180 -5.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -12.6300 -3.3660 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4380 -4.1610 -4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -6.6400 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -8.0900 4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -6.9260 5.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -4.8030 4.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -3.5560 2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4070 -6.3540 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -7.5990 2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -3.2020 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -3.0700 -2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -8.7140 -4.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -11.1560 -0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -3.9750 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.7810 -5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -3.2120 -4.8710 H 0 0 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 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END