CHEMDIV-ZINC01022894 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5280 -1.7820 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -0.3290 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 -1.0130 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 -1.3080 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8480 -0.9950 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 -1.2740 -2.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5020 -0.3180 -1.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6410 0.7630 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -0.7430 -2.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -1.9570 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -1.9340 -4.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -0.7280 -4.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 0.0340 -3.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -0.3200 -5.2800 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1680 -1.1180 -6.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 0.8130 -5.2930 O 0 5 0 0 0 0 0 0 0 0 0 0 6.5180 -1.3540 2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 -0.8260 2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1130 -1.3370 4.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 -2.2500 4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 -2.5160 3.5400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6690 0.7510 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -0.6440 2.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4200 -1.7960 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -2.8030 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2670 -0.0840 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 -1.0260 4.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4650 -2.7480 5.4820 H 0 0 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 27 2 0 0 0 0 26 39 1 0 0 0 0 27 28 1 0 0 0 0 27 40 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END