NIH-ZINC00251450 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 0.4170 1.7180 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.3300 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.2900 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 0.2800 -2.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -1.5750 -1.9810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -2.3870 -3.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5530 -1.7140 -3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -2.9130 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -3.5340 -2.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1170 -4.2830 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -3.0910 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 -3.3680 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 -2.8000 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -2.1100 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 -2.1570 -1.4540 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -3.5400 -4.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 -4.4300 -5.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 -5.6430 -5.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -6.4110 -4.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 -5.6350 -3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 1.6920 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 2.3990 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 2.1320 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.3260 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 0.3800 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -1.9640 -1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -2.0890 -4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -3.4130 -4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -3.6190 -3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -3.9480 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -2.8900 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 -1.5810 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -2.6320 -4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -3.2880 -5.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 -3.9110 -6.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 -4.6690 -4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -7.3280 -5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 -6.7000 -4.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -5.4030 -4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -6.1940 -2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -4.3090 -3.4530 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5000 -4.5650 -2.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 41 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 41 1 M END