54767914 -OEChem-05102418162D 201213 0 1 0 0 0 0 0999 V2000 17.2286 11.8820 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 16.5304 6.8189 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.6301 9.6927 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 11.9885 11.9631 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5770 11.3616 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.2702 18.3065 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.2702 17.3065 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.2702 18.3065 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6721 21.8065 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0382 22.1725 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.0382 20.4404 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 18.7282 17.0744 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.1301 8.8267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4961 10.1927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6301 6.6927 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1940 10.1336 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2986 7.0433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9940 3.1043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3748 3.7194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2182 13.6638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0298 9.5889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 7.8288 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4608 9.8979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3031 7.9333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3031 13.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 8.1927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3621 7.6927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7171 4.8141 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.1940 10.1336 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.1885 8.2971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.3100 6.9122 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2208 11.1767 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0298 11.7645 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7208 12.7155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9019 14.4381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4664 18.3065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.1446 18.0017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.1446 19.6112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7343 19.3065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8683 19.8065 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7640 9.1927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.8980 9.6927 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7643 10.1932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 9.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0320 8.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4564 10.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6301 7.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4961 8.1927 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.7391 7.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2829 11.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7053 9.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7391 6.4856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6940 9.2676 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.0991 8.3598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4462 5.7785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0488 12.3051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3431 12.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3621 6.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0852 5.5891 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.4121 6.0373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1192 5.3302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8752 13.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1695 12.9892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9356 13.6320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1940 10.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6940 10.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3620 3.8793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6940 9.2676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6940 10.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6940 9.2676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1594 11.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6388 2.1695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2287 11.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6732 12.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6738 1.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1863 1.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1940 8.4016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7148 12.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6249 0.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5597 0.5534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7873 7.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3965 7.3189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7215 14.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1190 7.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0326 7.0932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0145 8.4945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7208 8.6378 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4118 9.5889 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7208 8.6378 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2208 10.1767 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3086 7.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4118 11.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7208 12.7155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3086 13.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6003 17.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1984 18.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3324 17.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1984 19.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7343 18.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4664 19.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1362 19.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3324 19.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 19.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2702 19.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8683 17.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7282 18.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 18.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1362 20.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4042 19.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4042 20.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7282 18.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2702 21.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2702 18.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5382 21.3065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2282 17.9404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2282 19.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2282 17.9404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2282 19.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7282 18.8065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4729 10.4288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3749 10.3008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5522 10.7758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8199 9.7754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4214 9.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2271 7.8827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4331 8.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7220 7.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8738 10.8896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0670 10.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8201 8.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8091 8.6933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3380 7.3252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0491 8.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7062 9.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0888 9.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1402 6.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4291 5.9487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3566 9.7877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4646 7.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6356 8.6706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9383 5.4229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7082 5.2166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6903 5.7238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9200 6.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1501 6.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6114 4.9746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3813 4.7683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3501 13.6885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5869 13.2013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8279 14.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3292 4.9132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3840 8.7307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5394 11.8864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2224 2.6288 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3611 13.3354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5747 2.5194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0547 1.8728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6262 0.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6668 1.7245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0122 1.0034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4665 0.3091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2801 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0808 0.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1808 7.3591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2596 14.8396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4136 15.0698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1834 14.2238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3748 6.2956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1838 6.8834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7804 6.5268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5990 6.8410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2847 7.6596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6311 8.5593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9497 9.1111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3979 8.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1085 8.7348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9734 9.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3332 8.7348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7732 10.4581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7514 7.5570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4795 7.2328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3852 7.2624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 9.4830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8221 11.5729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6676 7.4317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2663 14.9397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2853 14.5029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2018 17.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9989 17.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3324 17.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9294 19.6165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3324 20.4265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8683 17.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4653 17.9965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6732 21.1165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8672 19.4965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2702 21.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9182 20.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5382 17.4035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5382 20.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3482 18.8065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 73 1 0 0 0 0 2 81 1 0 0 0 0 2 82 1 0 0 0 0 3 13 1 0 0 0 0 3 14 2 0 0 0 0 41 3 1 1 0 0 0 3 46 1 0 0 0 0 4 56 1 0 0 0 0 5 57 1 0 0 0 0 6113 1 0 0 0 0 7113 1 0 0 0 0 8113 1 0 0 0 0 9114 1 0 0 0 0 10114 1 0 0 0 0 11114 1 0 0 0 0 12115 1 0 0 0 0 13130 1 0 0 0 0 15 47 2 0 0 0 0 53 16 1 1 0 0 0 16 65 1 0 0 0 0 17 58 2 0 0 0 0 18 67 1 0 0 0 0 18 72 1 0 0 0 0 19 67 2 0 0 0 0 20 78 1 0 0 0 0 20 83 1 0 0 0 0 21 89 1 0 0 0 0 21 90 1 0 0 0 0 87 22 1 1 0 0 0 22182 1 0 0 0 0 88 23 1 1 0 0 0 23183 1 0 0 0 0 24 91 1 0 0 0 0 24185 1 0 0 0 0 25 94 2 0 0 0 0 26 41 1 0 0 0 0 26 47 1 0 0 0 0 26125 1 0 0 0 0 27 48 1 0 0 0 0 27 54 1 0 0 0 0 27 58 1 0 0 0 0 59 28 1 1 0 0 0 28 67 1 0 0 0 0 28151 1 0 0 0 0 29 69 1 0 0 0 0 29 70 2 0 0 0 0 30 77 1 0 0 0 0 30 82 2 0 0 0 0 31 82 1 0 0 0 0 31 84 1 0 0 0 0 31168 1 0 0 0 0 32 33 1 0 0 0 0 90 32 1 6 0 0 0 32 92 1 0 0 0 0 33 93 2 0 0 0 0 34 92 2 0 0 0 0 34 93 1 0 0 0 0 35 94 1 0 0 0 0 35186 1 0 0 0 0 35187 1 0 0 0 0 36 95 1 0 0 0 0 36 97 1 0 0 0 0 36100 1 0 0 0 0 37 96 1 0 0 0 0 37106 2 0 0 0 0 38 98 2 0 0 0 0 38106 1 0 0 0 0 39 40 1 0 0 0 0 39 99 2 0 0 0 0 40103 2 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42120 1 1 0 0 0 43121 1 0 0 0 0 43122 1 0 0 0 0 44 45 1 0 0 0 0 44123 1 0 0 0 0 44124 1 0 0 0 0 45 49 1 0 0 0 0 45126 1 0 0 0 0 45127 1 0 0 0 0 46 50 1 0 0 0 0 46128 1 0 0 0 0 46129 1 0 0 0 0 47 48 1 0 0 0 0 48 51 1 0 0 0 0 48131 1 1 0 0 0 49 52 1 0 0 0 0 49132 1 0 0 0 0 49133 1 0 0 0 0 50 56 2 0 0 0 0 50 57 1 0 0 0 0 51 53 1 0 0 0 0 51134 1 0 0 0 0 51135 1 0 0 0 0 52 55 1 0 0 0 0 52136 1 0 0 0 0 52137 1 0 0 0 0 53 54 1 0 0 0 0 53138 1 0 0 0 0 54139 1 0 0 0 0 54140 1 0 0 0 0 55 60 1 0 0 0 0 55141 1 0 0 0 0 55142 1 0 0 0 0 56 62 1 0 0 0 0 57 63 2 0 0 0 0 58 59 1 0 0 0 0 59 61 1 0 0 0 0 59143 1 0 0 0 0 60 61 1 0 0 0 0 60144 1 0 0 0 0 60145 1 0 0 0 0 61146 1 0 0 0 0 61147 1 0 0 0 0 62 64 2 0 0 0 0 62148 1 0 0 0 0 63 64 1 0 0 0 0 63149 1 0 0 0 0 64150 1 0 0 0 0 65 66 1 0 0 0 0 65 68 2 0 0 0 0 66 69 2 0 0 0 0 66 71 1 0 0 0 0 68 70 1 0 0 0 0 68152 1 0 0 0 0 69 73 1 0 0 0 0 70 77 1 0 0 0 0 71 74 2 0 0 0 0 71153 1 0 0 0 0 72 75 1 0 0 0 0 72 76 1 0 0 0 0 72154 1 0 0 0 0 73 78 2 0 0 0 0 74 78 1 0 0 0 0 74155 1 0 0 0 0 75 79 1 0 0 0 0 75156 1 0 0 0 0 75157 1 0 0 0 0 76 80 1 0 0 0 0 76158 1 0 0 0 0 76159 1 0 0 0 0 77 81 2 0 0 0 0 79 80 1 0 0 0 0 79160 1 0 0 0 0 79161 1 0 0 0 0 80162 1 0 0 0 0 80163 1 0 0 0 0 81164 1 0 0 0 0 83165 1 0 0 0 0 83166 1 0 0 0 0 83167 1 0 0 0 0 84 85 1 0 0 0 0 84 86 1 0 0 0 0 84169 1 0 0 0 0 85170 1 0 0 0 0 85171 1 0 0 0 0 85172 1 0 0 0 0 86173 1 0 0 0 0 86174 1 0 0 0 0 86175 1 0 0 0 0 87 88 1 0 0 0 0 87 89 1 0 0 0 0 87176 1 0 0 0 0 88 90 1 0 0 0 0 88177 1 0 0 0 0 89 91 1 6 0 0 0 89178 1 0 0 0 0 90179 1 0 0 0 0 91180 1 0 0 0 0 91181 1 0 0 0 0 92184 1 0 0 0 0 93 94 1 0 0 0 0 95 99 1 0 0 0 0 95188 1 0 0 0 0 95189 1 0 0 0 0 96 97 2 0 0 0 0 96 98 1 0 0 0 0 97190 1 0 0 0 0 98102 1 0 0 0 0 99105 1 0 0 0 0 100102 2 0 0 0 0 100191 1 0 0 0 0 101103 1 0 0 0 0 101104 2 0 0 0 0 101108 1 0 0 0 0 102192 1 0 0 0 0 103107 1 0 0 0 0 104109 1 0 0 0 0 104113 1 0 0 0 0 105107 2 0 0 0 0 105193 1 0 0 0 0 106111 1 0 0 0 0 107194 1 0 0 0 0 108112 2 0 0 0 0 108195 1 0 0 0 0 109110 2 0 0 0 0 109196 1 0 0 0 0 110112 1 0 0 0 0 110114 1 0 0 0 0 111115 1 0 0 0 0 111116 2 0 0 0 0 112197 1 0 0 0 0 115117 2 0 0 0 0 116118 1 0 0 0 0 116198 1 0 0 0 0 117119 1 0 0 0 0 117199 1 0 0 0 0 118119 2 0 0 0 0 118200 1 0 0 0 0 119201 1 0 0 0 0 M END > 54767914 > 1 > 2770 > 32 > 8 > 19 > AAADcfB//cJEAAAAAAAAAAAAGAAAAeLFixI8ePGCAAAAAFix/gAAHw4YCCAADT7t3z6/3/fMFjiuQzd3fICS/K9zvvkd2LW+f5mPfvPl+/vf/Cjv3hvb6Cf6+e+O4AACIgASCBDAAAREACQQIAAAAAAAAA== > 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine;[(1S,4R,6R,14S,18R)-18-[[8-chloro-2-[2-(isopropylamino)thiazol-4-yl]-7-methoxy-4-quinolyl]oxy]-14-(cyclopentoxycarbonylamino)-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadecan-4-yl]-[(2,6-difluorophenyl)methyl]phosphinic acid;1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,2,4-triazole-3-carboxamide > 5-[[6-[2,4-bis(trifluoromethyl)phenyl]-3-pyridazinyl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine;[(1S,4R,6R,14S,18R)-18-[[8-chloro-7-methoxy-2-[2-(propan-2-ylamino)-4-thiazolyl]-4-quinolinyl]oxy]-14-[[cyclopentyloxy(oxo)methyl]amino]-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadecan-4-yl]-[(2,6-difluorophenyl)methyl]phosphinic acid;1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-1,2,4-triazole-3-carboxamide > 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine;[(1S,4R,6R,14S,18R)-18-[8-chloro-7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-(cyclopentyloxycarbonylamino)-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadecan-4-yl]-[(2,6-difluorophenyl)methyl]phosphinic acid;1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazole-3-carboxamide > 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine;[(1S,4R,6R,14S,18R)-18-[8-chloro-7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-(cyclopentyloxycarbonylamino)-2,15-dioxo-3,16-diazatricyclo[14.3.0.04,6]nonadecan-4-yl]-[(2,6-difluorophenyl)methyl]phosphinic acid;1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazole-3-carboxamide > [2,6-bis(fluoranyl)phenyl]methyl-[(1S,4R,6R,14S,18R)-18-[8-chloranyl-7-methoxy-2-[2-(propan-2-ylamino)-1,3-thiazol-4-yl]quinolin-4-yl]oxy-14-(cyclopentyloxycarbonylamino)-2,15-bis(oxidanylidene)-3,16-diazatricyclo[14.3.0.04,6]nonadecan-4-yl]phosphinic acid;5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine;1-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1,2,4-triazole-3-carboxamide > 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine;[(1S,4R,6R,14S,18R)-18-[[8-chloro-2-[2-(isopropylamino)thiazol-4-yl]-7-methoxy-4-quinolyl]oxy]-14-(cyclopentoxycarbonylamino)-2,15-diketo-3,16-diazatricyclo[14.3.0.04,6]nonadecan-4-yl]-(2,6-difluorobenzyl)phosphinic acid;1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-1,2,4-triazole-3-carboxamide > InChI=1S/C46H56ClF2N6O8PS.C25H14F7N5.C8H12N4O5/c1-26(2)50-44-52-36(25-65-44)35-21-39(30-18-19-38(61-3)40(47)41(30)51-35)62-29-20-37-42(56)54-46(64(59,60)24-31-32(48)15-11-16-33(31)49)22-27(46)12-7-5-4-6-8-17-34(43(57)55(37)23-29)53-45(58)63-28-13-9-10-14-28;26-19-4-2-1-3-17(19)23-33-21-9-10-37(13-22(21)34-23)12-15-6-8-20(36-35-15)16-7-5-14(24(27,28)29)11-18(16)25(30,31)32;9-6(16)7-10-2-12(11-7)8-5(15)4(14)3(1-13)17-8/h11,15-16,18-19,21,25-29,34,37H,4-10,12-14,17,20,22-24H2,1-3H3,(H,50,52)(H,53,58)(H,54,56)(H,59,60);1-11,13H,12H2;2-5,8,13-15H,1H2,(H2,9,16)/t27-,29-,34+,37+,46-;;3-,4-,5-,8-/m1.1/s1 > OVBJGZBMSSEAGV-QSUFHGRPSA-N > 1717.5219671 > C79H82ClF9N15O13PS > 1719.1 > CC(C)NC1=NC(=CS1)C2=NC3=C(C=CC(=C3Cl)OC)C(=C2)OC4CC5C(=O)NC6(CC6CCCCCCCC(C(=O)N5C4)NC(=O)OC7CCCC7)P(=O)(CC8=C(C=CC=C8F)F)O.C1=CC=C(C(=C1)C2=NC3=CN(C=CC3=N2)CC4=NN=C(C=C4)C5=C(C=C(C=C5)C(F)(F)F)C(F)(F)F)F.C1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=O)N > CC(C)NC1=NC(=CS1)C2=NC3=C(C=CC(=C3Cl)OC)C(=C2)O[C@@H]4C[C@H]5C(=O)N[C@]6(C[C@H]6CCCCCCC[C@@H](C(=O)N5C4)NC(=O)OC7CCCC7)P(=O)(CC8=C(C=CC=C8F)F)O.C1=CC=C(C(=C1)C2=NC3=CN(C=CC3=N2)CC4=NN=C(C=C4)C5=C(C=C(C=C5)C(F)(F)F)C(F)(F)F)F.C1=NC(=NN1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)C(=O)N > 410 > 1717.5219671 > 0 > 119 > 9 > 0 > 0 > 0 > 0 > 3 > -1 > 1 5 255 > 100 102 8 101 104 8 101 108 8 103 107 8 104 109 8 105 107 8 108 112 8 109 110 8 110 112 8 111 115 8 111 116 8 115 117 8 116 118 8 117 119 8 118 119 8 53 16 5 2 81 8 2 82 8 87 22 5 88 23 5 59 28 5 29 69 8 29 70 8 41 3 5 30 77 8 30 82 8 32 33 8 90 32 6 32 92 8 33 93 8 34 92 8 34 93 8 36 100 8 36 97 8 37 106 8 37 96 8 38 106 8 38 98 8 39 40 8 39 99 8 40 103 8 42 120 5 48 131 5 50 56 8 50 57 8 56 62 8 57 63 8 62 64 8 63 64 8 65 66 8 65 68 8 66 69 8 66 71 8 68 70 8 69 73 8 71 74 8 73 78 8 74 78 8 77 81 8 89 91 6 96 97 8 98 102 8 99 105 8 $$$$