PUBCHEM-ZINC05757278 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0450 1.0240 -0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -0.3460 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -0.8430 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -0.0030 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.3870 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 1.8870 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 2.1690 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 1.6000 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 0.2620 -0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -0.5640 -0.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -0.3720 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -1.0860 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8130 -2.7840 2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1850 -3.4540 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2230 -2.4800 2.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2350 -1.5680 1.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 -0.7930 1.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4880 3.5460 -0.0910 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 4.3720 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 5.8430 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2830 6.8170 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9070 8.1580 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 8.4920 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 7.4650 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 6.1530 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 1.4230 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -1.0290 -0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -1.9190 -0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 2.9550 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -1.0800 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 0.4010 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 -0.4020 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -1.8730 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0190 -3.5180 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 -2.2230 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 -4.1320 3.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 -4.0450 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0640 -0.8700 1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4350 -2.1180 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 -0.2100 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9160 -0.1430 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 4.0670 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2410 4.1420 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 4.1980 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3330 6.5450 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 8.9380 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 9.5280 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 7.6740 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 -1.7750 1.1810 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8840 -2.3090 0.3090 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END