IBS-ZINC01816591 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.1750 0.0790 0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 0.2840 3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 2.2230 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 2.8240 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 4.3080 2.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 4.8880 3.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 5.5420 5.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7260 4.7620 5.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 5.9490 5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 5.4830 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 4.8370 3.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 4.3510 2.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8280 5.5190 5.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 6.5520 6.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 6.8420 7.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 6.9450 7.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3330 6.6180 8.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5750 7.2820 8.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5490 7.3600 9.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6790 8.1620 9.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8430 8.8690 8.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8850 8.7990 7.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7720 7.9970 7.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7290 7.8030 6.9170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 6.6770 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 6.7760 5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 7.8010 5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 8.7010 4.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 8.6460 3.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 7.6510 3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -1.0040 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 0.4450 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 0.3450 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 0.6880 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -0.8090 3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.6510 4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 2.4130 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 2.6280 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 2.3000 3.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 2.7080 4.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 4.8570 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 4.4300 1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 7.4490 8.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 5.9640 9.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4310 6.8110 10.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4400 8.2330 10.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7310 9.4820 8.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9980 9.3390 6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 6.0590 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 7.8960 5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 9.5140 3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 7.6530 3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 0.7220 2.1010 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5640 0.3640 2.2860 H 0 0 0 0 0 0 0 0 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 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END