D0H4DR -OEChem-04152113013D 68 71 0 0 0 0 0 0 0999 V2000 -3.5810 1.5088 -1.7244 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8339 2.6464 2.8457 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.8731 1.2995 -0.9535 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5147 -2.2420 1.9119 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4265 -3.3113 1.2266 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.3165 -1.0607 -0.5927 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1988 0.8289 -1.3259 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0448 1.9861 -1.9325 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5898 -1.5294 -1.0165 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8107 -0.8344 -0.0951 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8906 -0.1378 0.2521 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0908 1.2127 1.3075 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6202 0.0951 0.4964 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1316 2.1538 0.4957 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3757 0.6268 2.5803 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 2.1952 1.9202 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8952 -1.2660 -0.5295 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1618 -1.8401 -1.0081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6163 -1.7164 -0.7584 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4299 -0.8909 -0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3134 2.3196 -0.8774 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0963 2.8233 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2545 -1.8906 -2.5601 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4266 -3.2686 -0.4525 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7967 -1.6043 0.9761 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6701 -0.2326 -1.0087 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3559 -1.0009 0.0598 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4599 3.1551 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 3.6590 0.4274 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5962 -1.6593 1.0268 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7228 -0.2875 -0.9579 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8005 -1.0578 0.1126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4248 3.8249 -0.9456 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9522 -0.0510 -0.3281 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5592 0.0048 -0.3785 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5862 -1.1693 0.2134 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4346 -2.1762 0.6538 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8275 -2.2319 0.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0761 -1.2572 0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0770 2.3763 0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3353 0.3246 2.4586 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5711 1.1782 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8810 -0.3218 2.8298 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8722 1.6432 2.5531 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7261 2.9981 2.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7543 2.6669 1.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2283 -2.5586 -1.3161 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2253 -2.2793 -2.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4658 -2.5170 -2.9902 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1589 -0.8826 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3955 -3.6536 -0.7903 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4573 -3.2521 0.6434 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6455 -3.9711 -0.7621 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1207 0.2360 -1.8751 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5871 3.2940 -2.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5693 4.1872 0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1159 -1.4924 -0.9398 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0441 -2.2018 1.8545 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2717 0.1959 -1.7616 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2404 4.4745 -1.5068 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0831 0.9019 -0.7645 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 -3.0397 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3876 -2.0826 0.9311 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5337 -0.3617 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6198 1.8494 1.2323 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0923 2.6891 0.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6485 3.2485 0.1209 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5572 -1.5826 -0.9347 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 22 1 0 0 0 0 3 7 2 0 0 0 0 3 8 2 0 0 0 0 3 34 1 0 0 0 0 3 40 1 0 0 0 0 4 25 1 0 0 0 0 5 38 1 0 0 0 0 6 18 1 0 0 0 0 6 57 1 0 0 0 0 9 39 1 0 0 0 0 9 68 1 0 0 0 0 10 13 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 13 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 14 21 2 0 0 0 0 14 22 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 18 23 1 0 0 0 0 18 24 1 0 0 0 0 19 47 1 0 0 0 0 20 25 2 0 0 0 0 20 26 1 0 0 0 0 21 28 1 0 0 0 0 22 29 2 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 30 1 0 0 0 0 26 31 2 0 0 0 0 26 54 1 0 0 0 0 27 30 2 0 0 0 0 27 31 1 0 0 0 0 27 32 1 0 0 0 0 28 33 2 0 0 0 0 28 55 1 0 0 0 0 29 33 1 0 0 0 0 29 56 1 0 0 0 0 30 58 1 0 0 0 0 31 59 1 0 0 0 0 32 35 1 0 0 0 0 32 37 2 0 0 0 0 33 60 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 35 61 1 0 0 0 0 36 38 2 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 37 62 1 0 0 0 0 39 63 1 0 0 0 0 39 64 1 0 0 0 0 40 65 1 0 0 0 0 40 66 1 0 0 0 0 40 67 1 0 0 0 0 M END $$$$