PUBCHEM-ZINC01450953 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3640 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 1.3300 -0.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1360 0.6560 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 1.7860 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 3.0840 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 3.3310 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9410 4.6470 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 5.7020 0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2630 4.5760 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8340 3.3660 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 3.0350 -0.0520 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 2.1710 -0.0220 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 5.7910 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3790 6.2070 1.4160 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4520 6.3060 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 7.5360 1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1600 7.3620 2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8540 5.9490 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 5.2450 2.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -1.8190 -0.0240 N 0 3 0 0 0 0 0 0 0 0 0 0 0.9050 -2.7970 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0750 -2.0940 -0.0380 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8870 2.0030 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -0.6530 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.9110 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0170 5.5990 -0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 6.5920 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 7.6780 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 8.3740 1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1880 7.4180 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 8.1140 3.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7740 5.4540 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1540 6.0070 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END