PUBCHEM-ZINC04661295 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0470 1.4260 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.0530 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -0.8620 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -2.1540 0.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.0820 -0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.7830 -1.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -3.1660 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -2.8560 -2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -3.8930 -3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -5.2090 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -5.4350 -2.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -4.4540 -1.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.3720 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -2.9840 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -1.7110 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -1.5360 4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.4290 5.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -2.2970 7.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 -1.1280 7.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -1.0400 9.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.1190 9.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -3.2910 9.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -3.3990 8.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -4.6860 7.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -4.7100 6.2200 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3550 -0.5180 2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 0.6340 2.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 1.8690 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 1.7800 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 1.7960 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -1.8290 -3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -3.6690 -4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -6.0340 -4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -6.4440 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -3.8120 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -4.1260 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -3.8350 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -2.8300 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -0.5680 5.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -3.3930 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 -0.2650 7.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -0.1250 9.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -2.0520 10.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -4.1330 10.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -5.6300 8.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 2 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 25 -1 M END