NIH-ZINC06529953 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 -2.7030 -1.7760 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -3.0000 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -3.0440 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -1.8600 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -0.6320 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -0.5930 -3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -1.9180 -1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -1.6090 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -1.3640 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 -2.3140 -4.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -2.6310 -3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 -2.4200 -5.2390 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7760 -2.4270 -4.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 -3.7890 -5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0180 -4.9120 -5.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 -6.1240 -5.0130 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -7.0520 -3.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -5.5150 -5.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -6.9370 -6.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 -7.7300 -6.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 -8.3790 -7.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6050 -8.2380 -8.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -7.4550 -8.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2230 -6.8030 -7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 -1.2280 -6.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -1.1330 -7.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5820 -0.0130 -8.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 0.9930 -7.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0490 0.9530 -6.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -0.1510 -5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7120 -1.7410 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -3.9230 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -4.0130 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 0.3060 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 0.3610 -3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -1.1640 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.8980 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -2.5690 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -0.8010 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 -0.3480 -3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8040 -1.4230 -2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -3.0400 -5.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -1.3250 -5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.5260 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -3.6350 -3.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1290 -3.9190 -6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 -3.8250 -6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8210 -5.0120 -4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -7.8480 -5.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3990 -8.9990 -8.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 -8.7470 -9.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -7.3580 -9.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -6.2010 -7.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 -1.9200 -7.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0950 0.0700 -9.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 1.8840 -8.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 -0.1430 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -1.6430 -2.7720 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1630 -0.7130 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -2.3620 -4.3240 N 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 58 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 58 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 60 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 60 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 11 58 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 12 60 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 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 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 30 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END