PUBCHEM-ZINC05354521 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.2550 1.3920 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -0.0960 -0.0260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8230 -0.3460 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.4860 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -1.9460 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -2.8650 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -4.0920 2.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -4.9460 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -3.9990 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -2.6600 0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0520 -2.2940 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 -3.2740 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7980 -4.6020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -4.9900 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -0.9500 -1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -1.5420 -1.7830 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9620 -2.6160 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 -1.2810 -3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -1.9170 -3.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -1.8640 -4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0110 -2.5730 -3.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9260 -2.6040 -5.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6400 -1.9210 -6.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -1.2080 -6.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 -1.1780 -5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7600 -1.9560 -7.5260 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.6980 -0.9240 -0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -1.1770 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 1.9900 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.7080 -1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 1.6440 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 0.0860 1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -0.2000 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -2.7520 2.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 -1.2620 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 -2.9930 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5070 -5.3480 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -6.0250 1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -1.5540 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 0.0770 -2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -0.2030 -3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1520 -1.7070 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 -3.1090 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8530 -3.1620 -4.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 -0.6720 -7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -0.6090 -5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -0.8980 -0.3490 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0210 -1.8660 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -0.5630 0.1710 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 47 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 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 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 27 28 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 47 1 M END