PUBCHEM-ZINC00532419 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.4270 1.3720 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.1200 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -0.9530 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -2.2900 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -2.2500 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -0.9110 -1.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -0.4380 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 0.5540 -2.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 1.0120 -4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 0.4750 -5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -0.5060 -4.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -0.9670 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 1.0920 -6.8080 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7140 0.8850 -7.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 2.4910 -6.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 0.2020 -7.6920 N 0 5 0 0 0 0 0 0 0 0 0 0 0.3240 -0.7300 -7.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -3.3980 -1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -3.4500 1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -4.6150 1.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -5.6690 1.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -6.9550 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -7.7730 2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -7.0230 3.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -5.7740 3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 1.7450 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 1.7940 -0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 1.7530 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.6160 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 0.9560 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 1.7740 -4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 -0.9060 -5.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -1.7100 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -3.7800 -1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -3.1280 -2.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -4.2150 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -3.2430 2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -7.2160 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -4.9480 3.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 16 -1 M END