PUBCHEM-ZINC02845211 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 0 0 0 0 0 0999 V2000 -3.0160 -7.8920 -6.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -7.8770 -4.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 -6.5460 -4.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 -6.3570 -3.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -5.0890 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -4.8960 -2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -5.9730 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -7.2420 -2.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -7.4330 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -5.7780 -0.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 -6.8080 0.6560 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 -8.1240 0.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -6.2900 1.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -6.6720 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -7.5690 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -7.4650 1.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -6.4580 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 -5.5600 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -5.6720 2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -6.3500 3.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -7.4580 3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1200 -8.5540 3.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9270 -7.3340 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 -8.6680 4.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 -9.2570 6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -9.9620 6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5020 -10.5440 7.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -10.4250 8.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -9.7240 8.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -9.1350 7.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1710 -8.3660 7.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2310 -11.2960 7.5550 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5050 -11.4010 6.5830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -11.8090 8.6120 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.4250 -9.4760 3.9010 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2320 -10.2860 4.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -8.4510 3.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3080 -10.5050 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -7.5430 -5.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 -7.2360 -6.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -8.9080 -6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -8.5330 -4.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -8.2270 -5.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -4.2520 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -3.9090 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -8.0790 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -8.4210 -3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -5.0400 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -8.3520 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -8.1660 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -4.7760 3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -4.9760 2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -5.4780 3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8410 -6.7320 5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6210 -6.8560 3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -10.0560 5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -10.8810 9.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -9.6330 9.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9900 -9.0550 6.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3600 -7.8500 8.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -7.6350 6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -11.1400 3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8930 -11.1280 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 -9.8650 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 48 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 35 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 56 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 35 36 2 0 0 0 0 35 37 2 0 0 0 0 35 38 1 0 0 0 0 38 62 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 M CHG 1 32 1 M CHG 1 34 -1 M END