IBS-ZINC03984856 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4210 -1.6650 -1.5000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -0.9540 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5580 0.2580 -1.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 -1.7290 -1.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7550 -3.2410 -1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 -3.7700 -1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -4.7340 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -3.0030 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 -3.5620 -1.4980 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7390 -3.9490 -1.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6650 -1.3040 -2.7550 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8630 -0.2330 -2.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9730 -2.0500 -2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6790 -2.2000 -1.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8830 -2.8740 -1.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3900 -3.4030 -2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 -3.2560 -3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4770 -2.5800 -3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7420 -2.4530 -5.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6820 -1.3550 -5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 -1.5470 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2550 0.0070 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4480 -1.4440 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2840 -1.7870 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4290 -2.9870 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3330 -3.9300 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0850 -3.6680 -4.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4490 -2.2000 -6.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2590 -3.4010 -5.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1680 -0.3820 -5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -1.3820 -6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8770 -1.5950 -3.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -2.5410 -3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 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 16 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 19 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 47 48 1 0 0 0 0 M END