PUBCHEM-ZINC04764395 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4480 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 0.6180 -0.6110 1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 0.0490 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.1150 1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -2.5280 2.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -3.8370 2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -4.6740 1.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 -4.2610 3.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3750 -5.7240 3.8610 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9940 -6.3330 4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 -5.6710 5.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 -7.8380 4.9510 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0420 -8.2420 4.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -8.3680 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -9.8980 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -10.5260 2.2480 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 -12.3250 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -8.2500 6.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -9.4620 6.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 -10.2120 6.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -9.8410 7.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -11.1590 8.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 -11.4070 9.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2440 -11.0510 10.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -11.2780 11.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 -11.8610 11.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -12.2180 10.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 -11.9950 9.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -2.5190 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -2.4930 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -1.8580 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 -3.8580 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -3.8840 4.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -6.2540 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 -7.9880 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -8.0370 3.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -10.2780 4.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 -10.2290 3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9090 -12.6440 3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3870 -12.5960 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -12.8160 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -7.6510 6.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8440 -11.2150 8.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 -11.9140 7.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -10.5950 10.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6230 -10.9990 12.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8470 -12.0380 12.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7150 -12.6740 10.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 -12.2780 8.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 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 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 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 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END