PUBCHEM-ZINC03662290 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 1.5150 0.7830 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -0.2140 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -0.6070 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -1.5220 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7270 -2.0390 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -1.6580 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1710 -0.7610 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3130 -0.3260 -2.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -0.9060 -3.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -2.5770 -4.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 0.0480 -4.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.3270 -6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2580 -0.6800 -6.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -1.3000 -8.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -2.8180 -9.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6990 -3.4430 -10.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 -1.4920 -9.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -0.8150 -8.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 -3.0420 -10.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 1.4740 -4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.2090 -4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 3.0290 -5.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 3.4170 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 2.8150 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 2.0790 -3.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -3.1430 0.2100 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.4070 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.7360 -0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 0.9720 0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.2000 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -1.8140 2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -2.0430 -2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 0.5220 -2.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 0.5050 -6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -1.1680 -6.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -1.3720 -6.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 0.2290 -6.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -0.5750 -8.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 -2.1360 -8.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -3.5960 -9.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -2.2390 -10.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -4.0830 -10.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -4.0900 -9.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -2.0180 -8.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5860 -0.7070 -9.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -0.1960 -9.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -0.2030 -8.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3950 -3.6400 -9.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8980 -3.6910 -11.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7420 -2.2790 -10.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 1.8770 -5.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 1.5910 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 3.3090 -6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 4.0570 -5.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 2.8110 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -1.8710 -8.5910 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8360 -2.4370 -7.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7180 -2.4190 -10.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 14 56 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 56 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 58 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 58 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 56 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 19 58 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END