IBS-ZINC02290723 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 -0.0360 1.5630 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0330 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 -0.4640 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.5050 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -0.1300 -1.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -0.8810 -2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -0.2460 -3.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3310 1.0160 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.0320 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 2.0510 -0.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 3.0600 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 4.1540 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 5.1750 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 5.1560 -2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 4.1160 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 3.0420 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0590 2.0170 -3.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -0.7210 -4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -1.4140 -4.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 -0.4050 -5.6710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -0.9510 -6.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -1.1750 -7.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -1.7140 -8.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -2.0310 -9.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.8080 -8.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -1.2650 -7.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -2.0920 -2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 1.9470 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.9170 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 1.9150 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -0.3180 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -0.1120 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -1.5530 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7560 -0.0800 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -1.5920 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -0.0830 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 4.1830 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1750 6.0120 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 5.9790 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 4.1150 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 0.2020 -5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 -0.9290 -6.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -1.8890 -9.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -2.4520 -10.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -2.0570 -9.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 -1.0880 -7.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -2.4720 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -2.5700 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 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 41 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 M END