PUBCHEM-ZINC02972704 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 -0.6200 0.6030 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.8810 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -1.7690 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -3.1450 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -3.6530 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -2.7730 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.3890 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -0.4490 -2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -0.9060 -3.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.2570 2.0460 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -5.5700 1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -3.5960 2.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -4.3000 3.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -5.3280 2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -4.9050 3.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6510 -4.9990 4.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -5.7450 2.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 -6.2620 1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 -7.0160 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -7.2340 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0650 -6.7560 3.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -6.0290 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7000 -2.6670 4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5910 -1.1410 3.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -0.7420 2.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2270 -1.4610 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -2.9790 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 0.3230 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6090 0.3340 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 1.4150 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4710 2.5190 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 2.5380 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 1.4510 3.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 1.0690 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 1.0520 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.8300 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -1.3830 1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -4.7250 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -3.1990 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -1.5160 -3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -0.0280 -4.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 -1.4500 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -4.2760 3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -5.3940 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -6.3050 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -6.0890 0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3590 -7.4230 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0680 -7.8160 1.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9230 -5.6720 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -2.9670 5.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7390 -3.0020 3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -0.6840 4.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -0.8110 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5700 -1.1790 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1680 -1.1920 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -3.2830 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 -3.5080 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 -0.5190 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1060 1.3870 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1260 3.3600 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 3.4000 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1460 1.5170 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -3.3900 2.9560 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9110 -3.0720 3.0320 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 10 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 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 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 63 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END