PUBCHEM-ZINC00639707 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 0.1120 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.4940 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -1.8970 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -2.6580 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.0140 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -4.0690 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8750 -4.5670 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -3.6480 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 -2.4510 0.0350 O 0 3 0 0 0 0 0 0 0 0 0 0 -6.3200 -4.1690 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1670 -3.9620 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4610 -4.5190 1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4710 -4.1790 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1900 -3.3090 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1630 -3.0180 4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4320 -3.5780 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7380 -4.4290 2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7610 -4.7500 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0400 -5.6300 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0880 -5.9540 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7950 -5.4260 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 -5.8110 -0.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8660 -4.9250 -1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4360 -4.7610 -2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 1.1900 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 0.1030 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -2.5920 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -4.7110 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -5.6310 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8420 -3.3940 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2080 -2.8690 3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9440 -2.3460 4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1850 -3.3330 4.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7280 -4.8550 2.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0290 -6.0550 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3350 -6.6380 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 12 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 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 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 M CHG 1 12 1 M END