PUBCHEM-ZINC03725727 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -0.3000 1.5980 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.0900 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -0.4150 -1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -1.7710 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -2.7010 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -4.0810 -0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -4.5060 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 -3.5850 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -2.2170 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -1.2440 -3.2720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -1.6530 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 -5.0590 0.4330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7730 -4.5060 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -5.5480 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -5.0640 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4550 -5.7430 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -6.7330 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -6.8350 0.9320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 -5.4170 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6030 -7.0170 0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -8.1780 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -6.9230 -1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -5.7220 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 2.0450 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 1.8650 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 2.0370 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -0.1470 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -0.3310 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -2.3640 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -5.5590 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4400 -3.9680 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 -2.1430 -4.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.2980 -5.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 -0.7560 -4.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8170 -4.2470 3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -7.4050 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -5.7580 5.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9650 -5.8980 4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -4.3360 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -6.3380 1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8480 -7.4110 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -8.8860 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -8.7290 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -6.5590 -2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -7.5520 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -5.2200 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -5.0140 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -6.1960 -0.1630 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2360 -6.8240 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -7.7470 -0.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1000 -7.2220 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 48 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 48 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 50 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 48 1 M END