PUBCHEM-ZINC04853529 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7830 -4.2410 0.0060 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -4.6600 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -3.7980 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6650 -4.4640 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0020 -4.0560 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9820 -5.0320 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6160 -6.3680 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3490 -6.7310 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -5.8400 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -5.9360 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -7.1210 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8570 -7.7210 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -8.8890 1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -9.4610 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -8.8690 -1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -7.7010 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2650 -7.1210 -2.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -7.7720 -3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 -3.0080 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0260 -4.7540 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3840 -7.1270 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1340 -7.2750 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -9.3550 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -10.3740 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8590 -9.3190 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -7.8260 -3.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -8.7790 -3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2310 -7.2060 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END