PUBCHEM-ZINC02047593 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.1090 1.3950 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.1130 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8930 -0.4740 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -0.6030 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.3560 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -0.6950 -1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -1.3140 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -1.6180 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1610 -1.3100 -1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4900 -0.6900 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 -0.3890 -2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4120 0.2220 -3.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1680 -0.3510 -3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4930 -0.5910 -4.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1640 -1.0270 -3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7580 -0.1400 -5.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9240 -0.1380 -6.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8450 0.4250 -7.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6230 0.9510 -7.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 0.9320 -7.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 0.3750 -5.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 0.2380 -4.7960 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.0380 0.4610 -8.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4020 1.6020 -8.8110 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.8770 2.4490 -8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2120 1.6740 -9.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.7330 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 1.6620 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 1.9530 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.6090 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5010 0.0060 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -1.5560 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -0.1540 1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -1.6800 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 -0.0700 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 -1.5760 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 -2.1010 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2140 -1.5680 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 0.3630 -4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8530 -0.5400 -5.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5450 1.3730 -8.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5310 1.3370 -7.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7220 -0.6480 -8.4660 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.4100 -1.5220 -8.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5460 -0.6700 -9.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 22 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 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 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 24 1 M END