PUBCHEM-ZINC06506308 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.2310 1.2560 -0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -0.1690 -0.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7130 -0.8380 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -0.2950 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -1.2670 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 -1.4290 2.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -0.6260 3.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 0.3390 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 0.5040 2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -1.1010 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -1.4250 -1.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0160 -0.6640 -1.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 -3.9510 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3320 -0.9230 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2550 -0.1650 -0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6380 -0.4000 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1110 -1.4210 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2060 -2.1920 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8200 -1.9420 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -2.6510 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1600 -3.6760 -3.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5190 -2.4280 -2.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5380 0.4540 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1320 1.3530 0.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8340 0.0990 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7750 0.8820 0.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 1.6360 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 1.2940 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.9490 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -1.9120 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -2.1820 3.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.7520 4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 0.9650 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 1.2630 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -1.9840 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -0.2990 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 0.6330 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1740 -1.6310 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5760 -2.9880 -2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5950 0.7830 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7230 1.9310 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7770 0.5040 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3310 -0.6350 -0.4680 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5230 -1.4090 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 0.0940 -0.2000 H 0 0 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 4 1 0 0 0 0 2 43 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 22 2 0 0 0 0 12 14 2 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 43 1 M END