IBS-ZINC03881687 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.4830 1.0480 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.4330 0.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0230 -0.9210 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -0.6730 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -0.2550 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 -0.9130 -0.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9600 -1.9900 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -0.7320 -1.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4220 -1.1100 -1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1770 -2.6380 -0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -2.7950 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -1.6910 -2.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4580 -0.7070 -2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 -0.9500 -2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -1.7620 -2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0030 -3.0080 -2.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -2.1900 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.0660 -4.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -0.4290 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 0.7290 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 1.2110 -2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 1.0360 -1.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0260 1.7290 -0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -0.4040 -0.4680 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1790 -1.3750 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2190 -0.3460 0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 0.0890 0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 0.7970 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 1.4540 -1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 1.2140 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -1.6470 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 1.7290 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 1.2820 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 1.2900 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.1320 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -1.7320 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.8370 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -0.5340 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -3.2180 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -3.0650 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -3.7970 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -2.6520 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -0.4860 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -0.1090 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.8290 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -2.7560 -4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 0.8370 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 1.4330 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 0.7220 -3.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 2.2750 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -1.2490 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -1.2290 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -2.4180 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7940 0.3660 1.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2580 -1.3300 1.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -2.6300 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -1.7960 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1390 -1.2310 -3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1980 -1.0730 -2.2390 O 0 5 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 1 0 0 0 0 2 4 1 0 0 0 0 2 9 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 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 13 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 12 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 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 59 1 0 0 0 0 17 18 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 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 29 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M CHG 1 59 -1 M END