PUBCHEM-ZINC06067145 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -1.4500 2.1380 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 0.6840 -1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 0.1940 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -1.1390 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -1.9850 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -1.4950 -1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 -0.1580 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -2.3250 -3.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -3.6900 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -4.4630 -4.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2920 -4.3390 -4.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -5.9470 -3.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -6.6880 -5.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0480 -7.0450 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -7.7240 -6.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 -7.7940 -6.8950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 -8.2220 -7.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -7.1640 -5.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -7.0360 -5.3700 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4950 -6.7790 -6.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -7.8000 -6.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9440 -8.1580 -3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -7.1520 -3.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -8.1890 -7.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8580 -7.9760 -7.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -8.3940 -8.4590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -7.3100 -6.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -7.1690 -6.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 -6.8360 -5.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8330 -6.2330 -4.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 -8.9180 -9.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.9600 -4.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 2.7140 -1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 2.2460 -2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 2.5070 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 0.8530 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -1.5200 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 -3.0260 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 0.2250 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -3.7400 -2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -4.1300 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -6.0710 -3.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -6.3310 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -5.7710 -6.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -6.8840 -7.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 -7.5570 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -8.7980 -6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -9.1510 -4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -8.1750 -2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -7.5040 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -6.1810 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -8.2140 -9.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -9.6340 -9.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -9.4500 -8.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -4.0380 -4.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 -7.7590 -4.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -6.8480 -4.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 56 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 19 1 M END