NIH-ZINC02975285 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -0.6340 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.0460 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.3700 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 2.0610 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -0.6450 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6430 0.2810 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 -0.5120 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.5690 0.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 -2.4530 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 -1.5830 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0970 -1.7250 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0490 -0.9880 1.4060 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1390 -2.8140 2.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4840 -2.7730 3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5270 -3.8790 4.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8160 -3.8400 5.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9450 -3.0810 6.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0070 -2.4330 6.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2480 -3.0570 6.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4590 -2.2980 8.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6990 -2.3070 8.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7390 -3.0720 8.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5350 -3.8280 6.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2960 -3.8270 6.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0540 -4.5730 5.1780 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7660 -5.1100 4.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8420 -4.5630 4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6000 -5.5060 3.1900 S 0 0 0 0 0 0 0 0 0 0 0 0 14.8460 -2.9060 8.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3640 -2.3640 10.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1600 -1.6670 9.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 1.9210 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5630 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 3.1410 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5260 0.9960 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 0.8130 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -0.9620 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 0.1530 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -3.0880 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -3.0700 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 -1.0250 2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -2.2190 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 -2.6630 3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0180 -3.7840 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2910 -2.9240 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6060 -1.8040 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 -3.7280 5.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -4.8480 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6560 -1.7070 8.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3420 -4.4170 6.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1400 -3.1650 10.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0920 -1.6720 10.5310 H 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 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 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 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 33 1 0 0 0 0 24 25 2 0 0 0 0 24 31 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END