NIH-ZINC04040194 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.0390 1.5700 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 0.0810 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -0.7470 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.0660 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.0560 -0.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -2.8750 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -0.7690 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -0.4510 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.6680 -3.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -1.6110 -3.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -1.4230 -4.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -3.3430 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -0.3070 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -0.3760 3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 0.0730 4.7660 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2830 -0.5120 5.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.3350 5.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 -0.8970 4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -1.2910 4.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -0.9150 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -1.2840 2.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 -0.1670 6.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 1.0780 6.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5880 2.0350 8.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5400 1.8160 9.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8220 1.7610 10.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 0.6750 10.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 0.8300 9.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.5530 4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1410 2.0160 5.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 3.3840 6.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 4.2520 5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 3.8480 4.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 2.5170 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 0.2290 2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 1.9020 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 1.9670 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 2.0130 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -0.9410 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -2.4070 -5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -0.8340 -5.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -3.6440 1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -4.1460 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -3.2460 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -1.0650 6.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.1290 7.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 1.9750 7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 1.2490 6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1250 2.0150 7.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0330 2.9740 8.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2470 2.6500 9.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 0.8950 9.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 0.6780 11.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 -0.2720 10.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 1.7570 9.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -0.0310 9.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 1.3240 6.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 3.7630 6.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 5.3280 5.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 2.2480 3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 0.6280 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5530 0.9140 8.0670 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.0730 0.0360 7.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 51 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 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 33 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END