PUBCHEM-ZINC02548532 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.0470 1.4950 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.0250 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -0.5730 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.1030 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 -2.5830 0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -3.9440 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -4.4270 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5320 -3.6300 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7930 -4.2140 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9110 -5.5950 -0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7660 -6.3840 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -5.8250 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -6.6550 0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -6.1000 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -4.7870 0.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -7.0290 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -7.3990 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -8.2980 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 -9.1270 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -10.4450 -2.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -10.4140 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -9.6520 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.8650 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 1.8730 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 1.9100 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -0.4080 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5760 -0.3710 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 -0.1840 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -0.2190 -0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.4870 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -2.4520 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -1.9120 0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -2.5450 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6790 -3.5900 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8900 -6.0620 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -7.4670 -0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -6.5400 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -7.9110 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -7.9680 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -6.4940 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -7.2710 -3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -8.7570 -3.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 -9.2240 -3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -8.6510 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -11.4500 -0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -9.9700 -0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -10.1190 -1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -9.5800 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -8.2360 -1.4120 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2300 -7.7650 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 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 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 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 15 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 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 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 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 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 49 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 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END