IBS-ZINC05253045 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.5080 1.5980 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 0.1990 0.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -0.5360 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 0.0780 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.6680 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -2.0270 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -2.6470 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -1.9000 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -4.0220 2.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -4.6430 3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -3.9020 4.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3530 -4.4640 5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5090 -5.8470 5.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9180 -6.5920 4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -5.9610 3.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0470 -7.9720 4.1290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -8.5480 2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 -9.8230 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -10.8910 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8820 -10.6300 4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 -9.7330 5.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -8.5610 5.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -6.5110 6.2440 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7240 -6.8760 7.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 -6.6920 6.1080 O 0 5 0 0 0 0 0 0 0 0 0 0 3.9240 -3.6820 6.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 2.0520 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 2.0650 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.7450 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 1.1400 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.1880 4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -2.6080 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.3800 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -4.5410 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -8.6960 3.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 -7.8420 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -10.1730 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 -9.6790 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -10.8340 4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -11.8820 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -11.5840 5.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -10.1470 4.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -10.3370 6.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2800 -9.3330 6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -7.7980 6.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 -8.9250 5.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8120 -2.7190 6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -4.0980 6.8600 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END