IBS-ZINC04794728 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -8.4580 0.1160 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 0.4530 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2620 0.9850 -1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 1.2920 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 1.0520 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 0.5200 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 0.2450 0.4950 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9350 1.3680 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 0.5780 1.1170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 1.8700 -2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 3.6110 -3.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1350 2.8540 -4.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2650 3.3010 -5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 4.8040 -5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 5.5600 -4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8910 5.1140 -3.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9370 5.3310 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 5.8660 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 5.5080 -1.6550 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3610 5.8300 -2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 3.9930 -1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4250 3.6320 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 4.3330 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 5.8480 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 6.2100 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 3.5620 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3990 3.2280 0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 3.1820 -1.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2030 2.8500 -1.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8350 1.2020 -2.9420 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.5440 -0.9140 -1.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.2300 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 0.7880 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 0.3310 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 1.1410 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 2.4250 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 0.7290 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 1.6820 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 1.4030 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 1.7840 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 3.0680 -4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 3.0880 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 2.7620 -6.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 5.1230 -6.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 5.0170 -5.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 5.3470 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1480 6.6310 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 6.9390 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 5.5740 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 2.5530 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 3.9560 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6230 4.0080 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 4.0770 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 6.3460 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 6.1730 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 7.2890 -0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 5.8860 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -0.1240 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 3.3190 -2.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 58 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 59 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 28 1 0 0 0 0 11 59 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 59 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 3 0 0 0 0 28 29 3 0 0 0 0 M CHG 1 7 1 M CHG 1 30 -1 M END