IFLAB-ZINC04583271 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0410 -2.7570 3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -2.3870 2.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8610 -3.3520 4.8610 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 -3.5630 4.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6260 -5.0340 4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 -5.3880 6.1840 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 -5.2680 6.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -3.8020 6.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 -6.6670 6.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 -7.1950 7.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 -8.4690 8.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5640 -9.1460 7.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7770 -8.5650 5.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3460 -7.3850 5.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0460 -10.4310 7.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 -10.9530 6.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3980 -12.3000 6.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3050 -13.2800 6.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 -12.6920 8.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9620 -11.3340 7.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.9280 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -3.5160 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4700 -3.3260 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -2.9250 5.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 -5.6640 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6990 -5.1840 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2660 -5.8960 5.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -5.5890 7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 -3.1860 6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2720 -3.7230 6.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8420 -6.6270 8.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6700 -8.9260 9.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 -11.0850 5.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5360 -10.2480 5.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9130 -12.6940 5.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1110 -12.1660 7.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6130 -13.4450 6.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7600 -14.2280 7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -13.3660 8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 -12.5640 8.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 -10.9050 8.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2670 -11.4640 6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 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 17 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M END