Ketcher 01232014012D 1 1.00000 0.00000 0 43 47 0 1 0 999 V2000 10.2791 -8.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8667 -8.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8666 -9.6904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8172 -8.3824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8172 -9.3818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2797 -8.8818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7800 -9.7473 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.7802 -8.0162 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.6258 -7.7949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5213 -6.8009 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.5388 -8.2015 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.6258 -9.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5213 -10.9631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6082 -11.3696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3297 -11.5506 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2428 -11.1441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2253 -12.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0514 -11.7317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0337 -13.1321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9468 -12.7256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7553 -13.3132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7058 -13.0043 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.7552 -14.3126 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.2931 -13.8130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7059 -14.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2926 -13.8130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8801 -13.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8801 -14.6215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.8306 -13.3133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8306 -14.3126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.6390 -12.7258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5345 -11.7318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5521 -13.1322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3432 -11.1443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3607 -12.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2562 -11.5508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6215 -11.3253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6568 -14.1261 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 19.5170 -10.3314 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.6040 -9.9249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9234 -9.4184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5109 -10.2269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7116 -12.2941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 2 0 0 0 2 4 2 0 0 0 3 5 1 0 0 0 4 5 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 1 6 1 0 0 0 9 10 1 0 0 0 9 11 1 0 0 0 4 9 1 0 0 0 5 12 1 0 0 0 12 13 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 15 16 1 0 0 0 15 17 1 0 0 0 16 18 1 0 0 0 17 19 1 0 0 0 18 20 1 0 0 0 19 20 1 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 21 23 1 0 0 0 22 24 1 0 0 0 23 25 1 0 0 0 24 25 2 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 26 28 2 0 0 0 27 29 1 0 0 0 28 30 1 0 0 0 29 30 1 0 0 0 29 31 1 0 0 0 31 32 1 0 0 0 31 33 2 0 0 0 32 34 2 0 0 0 33 35 1 0 0 0 34 36 1 0 0 0 35 36 2 0 0 0 32 37 1 0 0 0 33 38 1 0 0 0 37 39 1 0 0 0 39 40 1 0 0 0 39 41 2 0 0 0 39 42 2 0 0 0 29 43 1 6 0 0 M END