TNR CCTOOLS-0919241035 41 41 0 0 1 0 0 0 0 0999 V2000 -0.1720 0.1740 4.8550 O 0 0 0 0 0 0.9440 0.1030 4.1130 C 0 0 0 0 0 1.9180 -0.4700 4.5410 O 0 0 0 0 0 0.9830 0.7390 2.7470 C 0 0 0 0 0 2.3540 1.1710 2.4480 N 0 0 0 0 0 0.5280 -0.2770 1.6990 C 0 0 0 0 0 0.5650 0.3250 0.4030 O 0 0 0 0 0 0.1320 -0.6690 -0.5260 C 0 0 0 0 0 0.1560 -0.0810 -1.9390 C 0 0 0 0 0 1.5230 0.3170 -2.2810 N 0 0 0 0 0 2.3520 -0.5600 -2.8800 C 0 0 0 0 0 3.7590 -0.1490 -3.2310 C 0 0 0 0 0 1.9660 -1.6810 -3.1360 O 0 0 0 0 0 -0.7630 1.1430 -1.9890 C 0 0 0 0 0 -0.8660 1.6110 -3.3350 O 0 0 0 0 0 -2.1490 0.7370 -1.4740 C 0 0 0 0 0 -2.7410 -0.1950 -2.3800 O 0 0 0 0 0 -1.9990 0.0900 -0.0950 C 0 0 0 0 0 -1.1920 -1.0810 -0.1970 O 0 0 0 0 0 -3.3800 -0.2890 0.4400 C 0 0 0 0 0 -3.2420 -0.8930 1.7280 O 0 0 0 0 0 -0.1970 -0.2330 5.7310 H 0 0 0 0 0 0.3180 1.6020 2.7290 H 0 0 0 0 0 2.9320 0.3440 2.4750 H 0 0 0 0 0 2.3550 1.4930 1.4910 H 0 0 0 0 0 -0.4890 -0.5980 1.9210 H 0 0 0 0 0 1.1930 -1.1400 1.7170 H 0 0 0 0 0 0.8010 -1.5270 -0.4770 H 0 0 0 0 0 -0.1930 -0.8290 -2.6510 H 0 0 0 0 0 1.8320 1.2140 -2.0760 H 0 0 0 0 0 4.2740 -0.9850 -3.7050 H 0 0 0 0 0 3.7290 0.6950 -3.9190 H 0 0 0 0 0 4.2910 0.1380 -2.3240 H 0 0 0 0 0 -0.3550 1.9320 -1.3570 H 0 0 0 0 0 -1.4520 2.3800 -3.3190 H 0 0 0 0 0 -2.7820 1.6210 -1.3950 H 0 0 0 0 0 -3.6090 -0.4230 -2.0190 H 0 0 0 0 0 -1.5270 0.7970 0.5860 H 0 0 0 0 0 -3.9960 0.6060 0.5240 H 0 0 0 0 0 -3.8540 -0.9930 -0.2420 H 0 0 0 0 0 -4.1330 -1.1160 2.0290 H 0 0 0 0 0 1 2 1 0 0 0 1 22 1 0 0 0 2 3 2 0 0 0 2 4 1 0 0 0 4 5 1 0 0 0 4 6 1 0 0 0 4 23 1 0 0 0 5 24 1 0 0 0 5 25 1 0 0 0 6 7 1 0 0 0 6 26 1 0 0 0 6 27 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 8 19 1 0 0 0 8 28 1 0 0 0 9 10 1 0 0 0 9 14 1 0 0 0 9 29 1 0 0 0 10 11 1 0 0 0 10 30 1 0 0 0 11 12 1 0 0 0 11 13 2 0 0 0 12 31 1 0 0 0 12 32 1 0 0 0 12 33 1 0 0 0 14 15 1 0 0 0 14 16 1 0 0 0 14 34 1 0 0 0 15 35 1 0 0 0 16 17 1 0 0 0 16 18 1 0 0 0 16 36 1 0 0 0 17 37 1 0 0 0 18 19 1 0 0 0 18 20 1 0 0 0 18 38 1 0 0 0 20 21 1 0 0 0 20 39 1 0 0 0 20 40 1 0 0 0 21 41 1 0 0 0 M END $$$$