IBS-ZINC04040513 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 1 0 0 0 0 0999 V2000 1.0630 1.0250 1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -0.3290 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -1.4870 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -2.7480 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.8840 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -1.7170 -0.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.4550 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -4.2840 -0.2140 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2440 -4.9250 0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -4.4040 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7550 -5.8570 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -4.8220 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 -5.8740 -0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -6.3830 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -5.8430 -2.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -4.7990 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -4.2870 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 -6.2420 -3.1010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 -7.0930 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 -8.5520 -2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7580 -6.7250 -3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 1.3400 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 1.7680 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 1.0120 3.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 -1.4140 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -3.6290 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -1.7620 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 0.4330 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -3.9430 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -3.8540 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 -6.3470 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -6.4410 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -6.3100 0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -7.2050 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 -4.3710 -3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 -3.4590 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5420 -6.9210 -1.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 -9.2230 -2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -8.8320 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9890 -8.7220 -3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -5.6720 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5770 -7.3410 -2.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 -6.8440 -4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -5.9020 -2.0410 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.3370 -6.8730 -2.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -5.4110 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -5.4760 -1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 M CHG 1 44 1 M END