IFLAB-ZINC04247469 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8190 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.5620 0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -2.3320 2.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -3.7860 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -4.1660 3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -3.3420 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -1.8540 4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -1.4470 3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.7280 6.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -3.5440 7.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.9080 8.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -4.4750 9.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.5990 10.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -4.1280 10.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -3.6960 9.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -3.1640 9.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -2.8400 8.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -3.0240 7.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -4.1030 12.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -4.3250 12.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 -4.3000 13.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -4.0550 14.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 -3.8340 14.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -3.8520 13.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -3.5680 15.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.2960 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -4.0740 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -3.9610 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -5.2270 4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 -3.5300 4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 -1.6700 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2690 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -1.5480 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 -0.4140 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -4.1120 6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -4.7570 8.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0670 -2.4100 8.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -4.5170 11.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2210 -4.4720 13.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -4.0360 15.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -3.6750 13.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -2.4960 15.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -3.9340 15.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -4.0810 16.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END