PUBCHEM-ZINC06564231 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.1370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 0.5520 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -0.5490 -2.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -0.1800 -3.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.5760 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -0.1890 -6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 0.6060 -5.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2600 0.9660 -7.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 0.5400 -8.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -0.2490 -8.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -0.6090 -7.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -0.6990 -9.7380 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0760 -1.3920 -9.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 -0.3780 -10.7700 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.1550 0.0340 1.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.5500 2.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -1.5490 2.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 0.0230 3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 -0.5800 4.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 -0.0390 5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 1.0980 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 1.7000 4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 1.1730 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -1.1000 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -1.1900 -4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 0.9360 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1490 1.5790 -7.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -1.2190 -7.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 0.8310 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -1.4670 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -0.5050 6.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 1.5160 6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 2.5870 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 1.6470 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3770 0.8970 -9.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0570 1.7270 -9.9190 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 6 1 0 0 0 0 4 20 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END