PUBCHEM-ZINC05296782 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -1.9030 2.0400 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 0.5860 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.3830 0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 0.0320 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -1.7330 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -2.7280 -0.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6750 -3.4830 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -3.4460 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -3.8790 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 -4.8060 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -5.6350 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -6.4500 4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 -6.4460 4.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0340 -5.6300 3.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3210 -4.8200 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -3.9290 1.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -3.7350 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7220 -3.3560 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -2.3270 0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5550 -1.5770 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3110 -2.9800 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -1.9900 -2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -2.7410 -3.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -1.2130 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -2.2670 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -2.4980 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 2.7040 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 2.2550 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 2.2810 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 0.3870 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 0.4310 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -4.3140 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -2.7690 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -5.6440 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -7.0900 5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -7.0870 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 -5.6260 3.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -3.7470 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2460 -3.5260 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -1.2790 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -3.4840 -3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7570 -2.0480 -4.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -3.2620 -3.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 -0.6660 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9860 -0.4840 -2.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -1.8850 -2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -1.8020 -1.9090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 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 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 M CHG 1 47 -1 M END