OpenBabel01272018393D 51 53 0 0 1 0 0 0 0 0999 V2000 9.1160 16.0980 59.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 16.9150 59.3700 C 0 0 0 0 0 1 0 0 0 0 0 0 8.7990 15.0250 57.9910 C 0 0 0 0 0 1 0 0 0 0 0 0 10.2730 16.9410 58.5040 C 0 0 0 0 0 1 0 0 0 0 0 0 9.7080 15.3800 60.4890 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9360 14.7290 60.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8400 14.4200 60.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8840 16.5330 61.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5650 15.8190 62.8580 C 0 0 1 0 0 0 0 0 0 0 0 0 11.2310 16.8380 63.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3950 17.4700 62.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1620 18.6860 62.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2060 19.3510 61.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5050 18.7940 61.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7640 17.5730 62.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7010 16.9050 62.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6000 15.3690 63.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6780 16.0960 64.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9130 14.2450 64.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 13.6870 65.4460 C 0 0 1 0 0 0 0 0 0 0 0 0 8.1770 12.5680 64.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8770 12.2330 65.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7750 11.2140 66.6560 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 12.7740 65.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8150 12.1090 66.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 11.1890 67.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0840 13.1450 66.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7220 12.0980 66.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1340 13.8920 67.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9580 13.6050 68.7020 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5650 14.8660 69.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3190 15.4980 68.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1700 16.6640 68.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8010 17.2940 67.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8180 16.3160 66.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2450 14.9070 66.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2460 14.4230 67.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2730 12.9040 69.8880 C 0 0 1 0 0 0 0 0 0 0 0 0 9.3960 13.7580 70.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 11.6040 69.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4900 10.6970 70.6930 C 0 0 1 0 0 0 0 0 0 0 0 0 8.3540 9.6780 70.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6710 8.5120 71.3910 C 0 0 0 0 0 1 0 0 0 0 0 0 7.0380 10.1740 71.0900 C 0 0 0 0 0 1 0 0 0 0 0 0 10.7830 9.9610 70.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5020 9.6090 70.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9780 9.7270 72.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0110 8.9910 72.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3710 9.5010 72.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2550 8.5750 73.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6900 8.7540 72.9610 C 0 0 0 0 0 1 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 3 1 1 0 0 0 0 4 1 1 0 0 0 0 5 7 2 0 0 0 0 5 8 1 0 0 0 0 6 5 2 0 0 0 0 9 8 1 6 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 11 10 1 0 0 0 0 12 11 2 0 0 0 0 13 12 1 0 0 0 0 14 13 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 19 1 6 0 0 0 20 27 1 0 0 0 0 21 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 26 1 0 0 0 0 24 22 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 27 29 1 0 0 0 0 28 27 2 0 0 0 0 30 29 1 6 0 0 0 30 31 1 0 0 0 0 30 38 1 0 0 0 0 32 33 1 0 0 0 0 32 31 1 0 0 0 0 34 33 1 0 0 0 0 35 34 1 0 0 0 0 36 35 1 0 0 0 0 36 37 1 0 0 0 0 37 32 1 0 0 0 0 38 40 1 6 0 0 0 38 39 1 0 0 0 0 41 40 1 6 0 0 0 41 45 1 0 0 0 0 42 41 1 0 0 0 0 42 44 1 0 0 0 0 42 43 1 0 0 0 0 45 47 1 0 0 0 0 46 45 2 0 0 0 0 47 48 1 0 0 0 0 49 48 1 0 0 0 0 49 50 1 0 0 0 0 51 50 1 0 0 0 0 M RAD 8 8 3 9 2 10 3 12 2 13 2 14 2 15 2 16 2 M RAD 8 19 2 20 2 21 3 23 2 24 2 26 2 29 2 30 2 M RAD 8 31 3 32 2 33 3 34 3 35 3 36 3 37 3 38 2 M RAD 8 39 2 40 3 41 2 42 2 47 2 48 3 49 3 50 3 M END