NIH-ZINC04004600 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -2.0900 -0.0920 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -0.8220 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -0.7670 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -1.4350 0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 -2.1600 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -2.2170 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -1.5490 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -2.9480 -2.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -2.4430 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 -3.1470 -4.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -4.6000 -4.2740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -5.1660 -3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -4.3820 -1.9550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4910 -4.5550 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -4.8480 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -5.3930 -4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -6.5980 -4.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0420 -4.7820 -5.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5330 -3.9390 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 -4.2960 -7.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -3.6460 -8.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -4.6840 -8.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9810 -5.2610 -7.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -5.8320 -6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 -5.2680 -7.1080 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -6.3220 -6.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 -5.1870 -8.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -3.7710 -6.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -2.5970 -6.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6200 -1.7110 -5.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 -2.2900 -4.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1050 -3.5750 -4.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 -4.2360 -4.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 0.9190 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9690 -0.6230 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -0.0450 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -0.2000 2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -1.3900 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3410 -2.6810 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -1.5940 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -1.3680 -3.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -2.6420 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -2.8650 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -2.8610 -5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -5.0780 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -6.2140 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -4.5670 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -5.9320 -0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -4.3790 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -5.1430 -7.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 -3.5660 -6.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8250 -3.2800 -9.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -2.8140 -7.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9160 -5.4720 -9.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1670 -4.2030 -9.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 -6.1080 -5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 -6.7140 -6.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4110 -2.4040 -7.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6070 -1.8200 -3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 M END