IFLAB-ZINC02694441 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.1650 1.5110 -0.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 0.0040 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 -0.5790 -0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1920 -0.2380 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3210 -0.0470 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -2.1070 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -2.7860 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -4.1780 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4040 -4.9150 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -4.2620 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -2.8640 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -2.1500 -2.1690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -2.8720 -3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -1.8300 -4.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7360 -1.0870 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -2.4620 -5.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -1.8120 -7.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8890 -2.6920 -6.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9900 -2.5340 -8.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3690 -0.5090 -7.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -1.1050 -3.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -0.8630 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.8510 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 1.7910 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 2.0480 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -0.4690 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -0.2320 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -0.1970 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 1.0260 1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 -0.5460 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 -2.2320 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -4.6850 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 -6.0000 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -4.8810 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 -3.4480 -3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -3.5300 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 -2.7450 -6.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -3.3200 -5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5170 -3.6660 -6.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 -2.2100 -6.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6530 -2.8860 -7.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6360 -2.7520 -9.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 -1.9250 -8.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 -3.4890 -8.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9070 0.0430 -7.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5910 0.1520 -8.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0770 -0.7120 -8.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -1.4150 -6.3240 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3520 -0.9800 -5.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 -0.6640 -6.6500 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 5 1 0 0 0 0 3 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 48 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END