IBS-ZINC01816773 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.8420 1.0050 1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -0.4680 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.7290 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -2.1330 0.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -2.5790 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -3.9540 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -4.5440 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 -3.7760 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 -2.3900 0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -1.7970 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 -4.3930 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3340 -5.7130 -0.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5370 -6.2700 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5980 -7.6440 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8130 -8.3180 -0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0010 -7.6100 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9620 -6.2310 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7300 -5.5330 -0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5780 -4.1460 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3630 -3.5960 0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6350 -3.2540 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5460 -3.1310 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9850 -2.8590 -0.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1310 -2.0000 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6860 -2.2560 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4160 -1.3520 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 1.1630 1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 1.6020 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 1.3780 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.8310 0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -1.0520 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -0.4050 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -0.1770 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -4.5780 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -5.6210 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 -1.7460 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -0.7240 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6710 -8.2120 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8240 -9.3940 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9530 -8.1280 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9060 -5.7060 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2050 -2.2930 -1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5370 -4.0120 -1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6170 -2.5800 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4150 -3.7290 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5540 -2.8770 1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1810 -1.1340 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1140 -2.5750 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2390 -1.3230 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8580 -2.2120 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9800 -1.1000 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3680 -0.4850 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0170 -1.7030 0.2350 N 0 3 0 0 0 0 0 0 0 0 0 0 -11.6250 -0.8770 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 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 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 53 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END