IBS-ZINC05180128 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.2180 0.9540 3.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 0.1090 1.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 0.8930 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 -1.1020 1.8440 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.1770 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -3.4150 1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -4.5080 0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -4.3730 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -3.1250 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -2.0390 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6950 -5.5390 -0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -5.8580 -0.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -6.3070 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -7.4960 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -7.9720 -3.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -8.9780 -3.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -7.1260 -2.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -6.0320 -2.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1830 -6.0150 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -4.7150 -2.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -3.6900 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.5800 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -2.7020 -4.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -4.2960 -4.2350 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -7.2710 -3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -6.7160 -4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3230 -5.2980 -4.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 -4.6620 -6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -8.0440 -2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 1.8780 2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 0.3960 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 1.1910 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -0.1290 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 0.2900 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.8160 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 1.1300 0.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.5180 1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -5.4690 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 -3.0160 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -1.0770 0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -3.7250 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 -1.6820 -2.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -1.9410 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1360 -6.7190 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -8.3250 -3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4590 -6.9550 -5.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -7.1640 -5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 -3.5800 -5.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -4.9420 -6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 -4.9780 -6.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -6.6380 -1.3660 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 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 29 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 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 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END