NIH-ZINC00251822 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 -2.1260 0.7060 1.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.5420 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -0.2500 -0.5110 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -0.0890 -1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.7330 -0.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 -1.7200 -0.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -2.8350 -1.4880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9580 -2.7660 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -2.6380 -3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -4.2210 -1.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7290 -4.2070 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -4.3170 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.3910 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -4.4440 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -4.4180 2.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 -4.3370 1.5450 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -5.4710 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -6.8770 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 -7.4660 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -6.0550 -2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -8.7980 -3.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 1.5220 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 1.0510 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 0.5040 2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 -0.8650 1.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -1.3410 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -1.6440 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -1.6380 -3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -2.7480 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -3.3520 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 -4.3980 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 -4.4970 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 -4.4440 3.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -4.8050 -2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 -5.1120 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -7.5690 -1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9850 -6.8330 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -7.8200 -3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -8.1780 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -6.1400 -2.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -5.4090 -3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 -8.6930 -3.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -9.4960 -2.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -9.1170 -4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -5.4760 -1.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -7.4490 -3.2760 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3830 -6.8110 -4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 45 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 45 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 46 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 45 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 46 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END