PUBCHEM-ZINC03827526 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 1 0 0 0 0 0999 V2000 0.5690 2.5540 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 1.3810 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 0.3460 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.4690 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 1.6570 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 2.6920 0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 -0.6700 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -0.2640 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -1.4260 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -2.3820 0.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -1.2180 0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2350 -2.1470 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8850 -1.9380 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2650 -2.1210 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0220 -2.5390 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4180 -2.7450 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0380 -2.5490 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7750 -2.7390 0.1440 S 0 0 0 0 0 0 0 0 0 0 0 0 12.3380 -2.9330 -1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2270 -1.6530 0.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9080 -4.1790 1.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4490 -5.4660 0.3580 C 0 0 3 0 0 0 0 0 0 0 0 0 11.2120 -5.3210 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4740 -6.5760 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6790 -6.4470 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8680 -7.0730 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0860 -6.6960 -2.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4760 -7.0010 -2.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7100 -5.8360 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8490 -5.6570 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2520 -4.7980 0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4930 -4.1560 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3310 -4.3580 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9550 -5.2030 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1820 -5.8690 1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0300 -5.1590 2.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 3.3590 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 1.2710 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -0.5610 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 1.7900 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 3.6060 1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -1.4930 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 0.0760 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 0.5810 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 -2.2170 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 -1.0480 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4390 -2.7560 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 -3.2190 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -0.4330 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -1.5530 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3230 -1.6020 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7260 -1.9470 2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 -3.0650 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5840 -2.7510 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3330 -4.1500 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7980 -6.5960 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0180 -7.5570 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2310 -7.7490 -2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5970 -4.6240 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7970 -3.4870 1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2880 -3.8460 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6040 -5.3530 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4830 -6.8000 0.6890 O 0 5 0 0 0 0 0 0 0 0 0 0 5.8680 -1.9710 -0.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 9 64 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 10 64 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 12 64 1 0 0 0 0 13 14 2 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 35 1 0 0 0 0 24 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 32 33 2 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 M CHG 1 63 -1 M END