PUBCHEM-ZINC03752551 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0000 1.3010 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.1940 0.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -1.0050 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.4000 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -2.9600 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.1910 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.7860 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -3.0910 -2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -4.3830 -1.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -4.2740 -0.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -5.0590 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -5.6850 -2.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -5.9730 -3.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -7.2190 -3.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -8.1860 -3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -7.8990 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -6.6630 -2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -8.8970 -2.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -8.5440 -2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -9.0630 -1.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1580 -8.7600 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -7.9490 -2.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9130 -7.4510 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -7.7560 -3.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -2.6870 -3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -2.0480 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2620 -2.8540 -4.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.6750 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.7660 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.6130 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.5510 2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -3.0200 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.1690 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -5.2250 -3.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -7.4260 -4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -9.1530 -4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -6.4550 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -9.6950 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -9.1540 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7740 -7.7110 -2.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -6.8210 -4.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9390 -7.3720 -4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -3.5440 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -1.9780 -3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -0.7820 -4.0880 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 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 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 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 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 45 -1 M END