NCID-ZINC01698168 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.1690 1.5430 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 0.0570 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8760 -0.1260 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -0.4010 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 -0.3140 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -0.7120 2.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -1.2080 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -1.2840 3.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.8850 2.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -1.8470 4.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -2.2440 5.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -2.1340 5.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -1.6360 4.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -2.5740 6.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.9640 4.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -0.7230 -0.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -0.9300 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -1.7070 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -1.9410 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -1.3820 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -0.6290 -3.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.4070 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -1.6140 -4.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6100 -2.6760 -5.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -0.5590 -5.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -0.5640 -7.1800 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4750 -1.2680 -7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -0.9230 -8.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -2.3460 -8.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -2.7630 -9.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -1.8430 -9.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 0.8730 -7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 1.7890 -6.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 2.1430 0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6350 1.9080 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 1.7420 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 0.0790 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -2.9700 7.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -2.5030 6.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.6360 6.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4150 -1.1380 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -2.1410 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5330 -2.5440 -2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -0.2190 -4.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 0.1890 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 0.3560 -5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 -0.8050 -9.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -0.2120 -8.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5310 -2.4660 -7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -3.0570 -8.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -4.0050 -9.2230 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.0200 0.9540 -8.4240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 -1 M END