PUBCHEM-ZINC04760709 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 0.8560 -0.2420 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.0900 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.8860 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -0.6210 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.3440 2.4720 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1500 -0.7840 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.9510 3.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.2480 4.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 1.1030 2.6620 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 1.6020 3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 0.8530 3.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 3.0900 3.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6120 3.4640 4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 3.7790 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 5.2970 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 6.1140 0.7490 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 7.8760 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 3.3760 4.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 4.5090 5.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 5.2950 5.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 4.7720 5.7160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 6.0110 6.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2640 6.1320 7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4110 5.6210 8.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6250 5.7320 9.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 6.3550 8.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5430 6.8680 7.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3280 6.7600 6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -1.2810 -1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3070 0.0540 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 0.3940 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 0.9620 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -1.9390 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -0.7780 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.5080 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -1.6950 1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -0.1220 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 1.7020 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 3.4960 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 3.4730 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 5.5810 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 5.6030 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 8.4730 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 8.0950 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7390 8.1180 1.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 2.7480 4.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 6.0110 7.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8160 6.8540 5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 5.1350 8.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7400 5.3320 10.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6380 6.4420 9.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3750 7.3540 6.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 7.1630 5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.2740 3.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 -2.6170 4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 54 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END