IBS-ZINC04870607 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 1.3170 -0.7400 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 1.2090 -0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.7560 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -0.0740 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -0.7770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -2.1690 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -2.8510 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.1560 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8280 -2.8810 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -2.2690 0.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3250 -1.5880 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1750 -3.4160 0.1150 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3320 -4.6650 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -4.2130 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9600 -4.9550 -0.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7300 -5.8030 -0.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0990 -3.2590 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7040 -2.7210 -2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.4810 -3.7600 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3410 -3.6160 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6350 -4.0880 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0820 -4.7020 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2360 -4.8470 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9380 -4.3860 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2580 -1.5240 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9280 -0.3160 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0260 0.3670 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4530 -0.1580 3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 -1.3660 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 -2.0510 2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 -0.0200 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -1.3570 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -1.3740 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 1.0060 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -0.2520 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -3.9310 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -2.6860 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 -3.4470 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9940 -3.1370 -2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3000 -3.9780 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0960 -5.0680 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5930 -5.3270 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2780 -4.5050 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3760 0.0930 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 1.3110 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5290 0.3770 4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -1.7750 4.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -2.9970 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 26 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 17 2 0 0 0 0 15 16 2 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 M END