NIH-ZINC04035739 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -4.4020 1.4600 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 -0.0470 1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2260 -0.6530 2.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -0.7830 0.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -0.0870 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -0.7810 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -2.1640 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 -2.8660 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -2.1800 0.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 -4.2650 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -4.9470 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -4.3500 0.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -6.2910 0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -7.0070 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -6.4710 0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0890 -7.1770 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 -8.4170 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -8.9660 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -8.2460 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -10.2140 -0.9950 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -10.8230 -1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0480 -11.9070 -1.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5520 -10.2380 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6760 -9.3170 0.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 -10.9210 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 1.8240 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 1.8260 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 1.8200 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4390 0.9930 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.2420 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -2.7000 -1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 -2.7240 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -4.7450 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -6.7620 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8460 -5.5050 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9640 -6.7620 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9690 -8.6560 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7310 -9.5620 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2900 -11.0390 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -10.7070 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9890 -11.9940 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3200 -10.5880 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 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 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END