PUBCHEM-ZINC06891184 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 1.1710 -0.0050 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -1.4780 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -1.6650 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -3.1360 0.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6200 -3.5540 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -3.2300 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -3.5500 -1.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -3.5250 -1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 -3.2200 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -2.9020 1.2800 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -3.8610 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -4.2360 -2.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -3.7550 -3.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -3.0520 -3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5000 -4.3600 -4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -5.1250 -5.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -5.7580 -6.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1660 -3.9480 -6.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3470 -3.3110 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0060 -5.2520 -8.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 0.1070 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.5220 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 0.4800 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -1.9380 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -1.9730 1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -1.2320 1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.0830 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1060 -3.1630 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6870 -3.7710 -3.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -2.5890 -4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -2.2480 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 -5.0970 -4.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8610 -4.4600 -6.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -5.9060 -5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -6.2210 -7.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -6.5050 -6.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8930 -4.6680 -6.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6870 -3.1820 -7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0220 -2.8130 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -2.5270 -5.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7240 -5.9890 -8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 -5.7120 -9.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5160 -4.4260 -9.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2480 -4.6890 -7.4780 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5890 -4.0030 -7.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -3.9460 1.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -3.9470 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -4.9170 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 46 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 44 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 44 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 44 1 M END