CHEMBRIDGE-ZINC04755995 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -0.1230 1.4440 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.0450 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -0.8850 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -2.2690 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -2.8260 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -1.9940 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -0.6090 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 -4.3000 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -4.9470 0.8690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -4.9760 -1.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5560 -5.4540 -2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -6.9470 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -7.6030 -2.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 -7.3810 -1.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -6.2930 -1.3540 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9390 -6.4400 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -6.3130 -2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -6.0150 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1830 -6.0100 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -6.3000 -3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 -6.5830 -4.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -6.5860 -3.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2320 -6.3120 -4.8120 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.3340 -6.0960 -4.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0690 -6.5400 -6.0190 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0480 -8.7890 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -9.2470 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -11.6110 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -11.0700 1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -4.7540 -2.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 1.8560 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 1.9120 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 1.7100 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -0.4640 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -2.9000 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0200 -2.3880 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 0.0340 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1780 -5.7820 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1540 -5.7780 -2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -6.8030 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -6.8090 -4.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -8.9500 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -9.3600 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -9.0550 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -8.7100 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1990 -11.3670 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -11.4300 -1.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 -12.6530 -0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6640 -10.4810 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -10.8290 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -12.1350 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -4.3110 -2.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -10.7330 0.2260 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7350 -10.9580 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 52 1 0 0 0 0 11 12 1 0 0 0 0 11 30 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 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 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 53 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 53 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M CHG 1 53 1 M END