PUBCHEM-ZINC03874330 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 4.2320 1.4510 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 0.5050 -0.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -0.8010 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -1.1570 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -0.2140 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 1.0880 -1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3870 2.1290 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3970 3.2400 -1.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1200 1.7540 -3.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1710 2.5730 -4.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0920 3.6040 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5590 1.9890 -3.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9570 2.1500 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1690 1.2600 -2.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8840 0.0760 -1.7930 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 2.5610 -5.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5120 1.5230 -6.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8620 -1.9910 0.1950 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7770 -2.9190 0.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.2390 0.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -2.7780 -1.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -2.0570 -1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -2.3010 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -3.7070 -3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -3.7330 -1.9280 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7980 -3.3900 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -5.1430 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -5.5050 -0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -5.9870 -2.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -7.4010 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 -7.6460 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1950 -9.1320 -0.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -9.9360 -1.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 2.4750 -1.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.8040 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5550 -2.1560 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9950 -0.4870 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 0.8690 -4.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5780 0.9250 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3240 2.4730 -4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1930 3.1980 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1480 1.8510 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -2.4960 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -0.9890 -1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -2.2010 -3.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -1.5920 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -4.4420 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -3.9230 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 -5.6210 -2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -7.7600 -1.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 -7.9160 -2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 -7.1960 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 -7.1700 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2950 1.8170 -2.2620 O 0 5 0 0 0 0 0 0 0 0 0 0 8.5200 3.5820 -6.3520 O 0 5 0 0 0 0 0 0 0 0 0 0 6.2090 -9.3800 0.2030 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 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 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 54 1 0 0 0 0 16 17 2 0 0 0 0 16 55 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 54 -1 M CHG 1 55 -1 M CHG 1 56 -1 M END