TKP CCTOOLS-1004241124 76 78 0 0 1 0 0 0 0 0999 V2000 -4.0620 2.4090 -0.9780 C 0 0 0 0 0 -4.5150 0.2230 -2.1000 C 0 0 0 0 0 -4.3110 0.9160 -0.7520 C 0 0 0 0 0 -3.1050 0.3000 -0.0390 C 0 0 0 0 0 -0.7630 -0.0160 -0.3700 C 0 0 0 0 0 -5.5430 0.7350 0.0980 C 0 0 0 0 0 -6.7620 1.2150 -0.3430 C 0 0 0 0 0 -7.8930 1.0490 0.4370 C 0 0 0 0 0 -7.8020 0.4030 1.6580 C 0 0 0 0 0 -6.5820 -0.0750 2.0970 C 0 0 0 0 0 -5.4540 0.0860 1.3140 C 0 0 0 0 0 -1.9190 0.4740 -0.8570 O 0 0 0 0 0 -0.7470 -0.5740 0.7090 O 0 0 0 0 0 -9.4250 1.6510 -0.1150 CL 0 0 0 0 0 0.3750 0.1120 -1.0800 N 0 0 0 0 0 1.6330 -0.4210 -0.5500 C 0 0 0 0 0 2.7910 0.3330 -1.1500 C 0 0 0 0 0 2.5860 1.2280 -1.9430 O 0 0 0 0 0 1.7490 -1.9040 -0.9080 C 0 0 0 0 0 0.6450 -2.6890 -0.1970 C 0 0 0 0 0 0.8640 -2.6190 1.3160 C 0 0 0 0 0 -0.2400 -3.4040 2.0270 C 0 0 0 0 0 -0.2020 -4.8650 1.5730 C 0 0 0 0 0 -0.4200 -4.9340 0.0600 C 0 0 0 0 0 0.6840 -4.1490 -0.6510 C 0 0 0 0 0 7.7250 0.2620 2.1230 O 0 0 0 0 0 7.1490 1.2970 1.8640 C 0 0 0 0 0 7.4180 2.4890 2.4250 N 0 0 0 0 0 6.5360 3.5370 1.8980 C 0 0 0 0 0 5.9380 2.9570 0.5970 C 0 0 0 0 0 6.0300 1.4370 0.8560 C 0 0 0 0 0 6.3750 0.6920 -0.4350 C 0 0 0 0 0 5.1800 0.7470 -1.3900 C 0 0 0 0 0 4.0550 0.0140 -0.8060 N 0 0 0 0 0 5.5670 0.1100 -2.7260 C 0 0 0 0 0 6.0550 -1.2140 -2.4990 O 0 0 0 0 0 -4.9210 2.8480 -1.4850 H 0 0 0 0 0 -3.9160 2.9020 -0.0170 H 0 0 0 0 0 -3.1710 2.5390 -1.5920 H 0 0 0 0 0 -3.6250 0.3540 -2.7140 H 0 0 0 0 0 -4.6930 -0.8400 -1.9390 H 0 0 0 0 0 -5.3740 0.6620 -2.6080 H 0 0 0 0 0 -2.9600 0.7940 0.9220 H 0 0 0 0 0 -3.2830 -0.7630 0.1220 H 0 0 0 0 0 -6.8320 1.7190 -1.2950 H 0 0 0 0 0 -8.6840 0.2780 2.2690 H 0 0 0 0 0 -6.5120 -0.5790 3.0490 H 0 0 0 0 0 -4.5010 -0.2890 1.6580 H 0 0 0 0 0 0.3630 0.5570 -1.9410 H 0 0 0 0 0 1.6480 -0.3070 0.5340 H 0 0 0 0 0 1.6460 -2.0260 -1.9860 H 0 0 0 0 0 2.7230 -2.2790 -0.5920 H 0 0 0 0 0 -0.3240 -2.2570 -0.4440 H 0 0 0 0 0 1.8340 -3.0520 1.5630 H 0 0 0 0 0 0.8360 -1.5790 1.6400 H 0 0 0 0 0 -0.0850 -3.3550 3.1050 H 0 0 0 0 0 -1.2100 -2.9720 1.7800 H 0 0 0 0 0 0.7680 -5.2970 1.8200 H 0 0 0 0 0 -0.9880 -5.4240 2.0790 H 0 0 0 0 0 -0.3930 -5.9740 -0.2640 H 0 0 0 0 0 -1.3900 -4.5020 -0.1870 H 0 0 0 0 0 0.5280 -4.1990 -1.7290 H 0 0 0 0 0 1.6540 -4.5810 -0.4040 H 0 0 0 0 0 8.1050 2.6370 3.0930 H 0 0 0 0 0 5.7420 3.7570 2.6130 H 0 0 0 0 0 7.1090 4.4380 1.6810 H 0 0 0 0 0 4.9020 3.2720 0.4700 H 0 0 0 0 0 6.5380 3.2400 -0.2670 H 0 0 0 0 0 5.0930 1.0660 1.2730 H 0 0 0 0 0 7.2380 1.1620 -0.9060 H 0 0 0 0 0 6.6080 -0.3470 -0.2040 H 0 0 0 0 0 4.8920 1.7860 -1.5520 H 0 0 0 0 0 4.2180 -0.7020 -0.1720 H 0 0 0 0 0 4.6920 0.0680 -3.3750 H 0 0 0 0 0 6.3440 0.7070 -3.2020 H 0 0 0 0 0 6.3190 -1.6800 -3.3050 H 0 0 0 0 0 1 37 1 0 0 0 1 38 1 0 0 0 1 39 1 0 0 0 2 3 1 0 0 0 2 40 1 0 0 0 2 41 1 0 0 0 2 42 1 0 0 0 3 1 1 0 0 0 3 4 1 0 0 0 4 12 1 0 0 0 4 43 1 0 0 0 4 44 1 0 0 0 5 13 2 0 0 0 5 15 1 0 0 0 6 3 1 0 0 0 7 6 1 0 0 0 7 45 1 0 0 0 8 7 2 0 0 0 9 10 2 0 0 0 9 8 1 0 0 0 9 46 1 0 0 0 10 11 1 0 0 0 10 47 1 0 0 0 11 6 2 0 0 0 11 48 1 0 0 0 12 5 1 0 0 0 14 8 1 0 0 0 15 16 1 0 0 0 15 49 1 0 0 0 16 19 1 0 0 0 16 17 1 0 0 0 16 50 1 0 0 0 17 34 1 0 0 0 17 18 2 0 0 0 19 51 1 0 0 0 19 52 1 0 0 0 20 25 1 0 0 0 20 19 1 0 0 0 20 53 1 0 0 0 21 20 1 0 0 0 21 55 1 0 0 0 21 54 1 0 0 0 22 23 1 0 0 0 22 21 1 0 0 0 22 57 1 0 0 0 22 56 1 0 0 0 23 24 1 0 0 0 23 59 1 0 0 0 23 58 1 0 0 0 24 25 1 0 0 0 24 61 1 0 0 0 24 60 1 0 0 0 25 62 1 0 0 0 25 63 1 0 0 0 26 27 2 0 0 0 27 31 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 28 64 1 0 0 0 29 30 1 0 0 0 29 65 1 0 0 0 29 66 1 0 0 0 30 67 1 0 0 0 30 68 1 0 0 0 31 30 1 0 0 0 31 32 1 0 0 0 31 69 1 0 0 0 32 33 1 0 0 0 32 70 1 0 0 0 32 71 1 0 0 0 33 35 1 0 0 0 33 72 1 0 0 0 34 33 1 0 0 0 34 73 1 0 0 0 35 36 1 0 0 0 35 74 1 0 0 0 35 75 1 0 0 0 36 76 1 0 0 0 M END $$$$