NIH-ZINC00621195 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.7620 1.3520 -0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -0.1650 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -0.7190 -1.7690 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -0.5680 -2.9990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -0.2490 -1.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -2.3580 -1.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -3.2620 -2.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -4.1720 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -4.8850 -0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -3.8490 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.9360 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 -5.8060 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6130 -5.8850 0.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -6.5430 1.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -7.3140 2.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -8.5230 2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -9.2900 3.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -8.8610 4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -7.6470 4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 -6.8700 3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -7.1860 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 -6.1320 4.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4640 -8.0230 6.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 1.8410 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 1.6110 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 1.6850 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -0.4240 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 -0.6530 -0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -2.6780 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -3.8690 -2.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -3.5710 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -4.9110 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -5.4650 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4780 -3.2520 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -4.3580 0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -3.5170 -1.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -2.1370 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -6.5390 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -8.8650 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -10.2280 4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -9.4640 5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6770 -5.9290 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6990 -8.1530 6.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -7.5240 6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -8.9980 5.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 M END