PUBCHEM-ZINC03657195 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7120 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.6980 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.9920 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6670 -1.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6540 -2.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.8380 -3.7590 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.7720 -4.8230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -1.1310 -3.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -0.6200 -4.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -0.9320 -4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 0.0160 -4.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 1.2960 -4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6860 1.6040 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 0.6460 -3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8640 2.3140 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 3.5050 -4.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 4.4520 -4.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 4.1190 -4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0130 5.0770 -4.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 6.3660 -4.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 6.7030 -4.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3380 5.7530 -4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 8.0850 -5.2780 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8080 8.9230 -5.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 8.3830 -5.4080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0640 -2.9080 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.1950 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -3.5950 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 -1.9210 -5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -0.2290 -5.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 2.5900 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 0.8840 -2.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 2.0730 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3260 3.1130 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0560 4.8220 -4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4160 7.1130 -4.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 6.0160 -4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -3.1170 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -3.8460 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -2.3460 3.1910 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END