ASINEX-ZINC04535638 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 0.2190 1.1170 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.5690 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 2.9470 -1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9860 0.7540 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 1.3030 -3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.1570 -4.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 0.2750 -5.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 -0.9940 -3.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -0.7490 -2.1210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1070 -1.1860 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -1.3640 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -1.0050 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -1.6030 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -2.5640 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -2.9320 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -2.3370 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -3.0670 2.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -3.9370 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 -2.3310 -3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -3.0250 -4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -5.2230 -5.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -6.5190 -6.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -6.1870 -6.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -7.0050 -7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 2.4920 -3.5610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 0.0500 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 1.6500 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 1.3300 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 -0.2580 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -1.3130 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -3.6780 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -2.6420 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7000 -3.4450 3.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -4.1920 3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -4.8690 2.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 -2.9290 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -2.2430 -4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -2.5140 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -3.0720 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -5.3900 -4.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -4.6150 -6.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -7.0050 -6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -7.2090 -5.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 3.1860 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -4.4330 -4.9050 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9050 -4.4820 -5.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -4.9480 -4.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 2 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 25 2 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 45 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 24 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END