PUBCHEM-ZINC02938799 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.1260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5430 -2.7680 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -4.2260 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -5.0050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -4.4990 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3680 -6.5060 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -7.1470 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3260 -6.7690 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6190 -8.6430 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -9.2610 1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -10.6320 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -11.3900 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 -10.7680 -0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3220 -9.3970 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -12.7390 0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -13.4550 -0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4570 -6.8150 -1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.0940 -6.5690 -1.2220 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 -6.2360 -2.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6600 -7.6620 -0.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -5.1320 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4220 -3.8850 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6610 -2.7580 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8760 -2.8770 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8520 -4.1250 1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 -5.2520 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1750 -1.4620 2.2380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 -2.4360 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -2.4450 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -2.4580 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0970 -2.4490 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 -4.6320 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8310 -6.8150 -0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -6.8250 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -8.6710 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8050 -11.1140 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9530 -11.3560 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1900 -8.9120 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -13.2900 -1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 -13.1020 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8550 -14.5200 -0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -6.7400 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -3.7920 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6790 -1.7840 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0200 -4.2190 2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6050 -6.2270 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END