@MOLECULE 95436263 27 27 1 SMALL USER_CHARGES @ATOM 1 F1 1.1775 3.0375 2.9121 F 1 noname -0.1655 2 O1 -0.9133 -2.2151 0.2153 O.3 1 noname -0.3867 3 N1 -0.6617 -2.0421 -2.7127 N.3 1 noname -0.3144 4 C1 -0.0755 -1.0175 -1.8006 C.3 1 noname 0.0340 5 C2 -0.8634 -0.9540 -0.4357 C.3 1 noname 0.0941 6 C3 -0.3848 0.0715 0.5200 C.2 1 noname -0.0444 7 C4 1.4101 -1.4136 -1.7260 C.3 1 noname -0.0469 8 C5 0.8984 -0.0526 1.0983 C.2 1 noname -0.0322 9 C6 -1.1689 1.2134 0.8127 C.2 1 noname -0.0322 10 C7 -2.0281 -1.8114 -3.2489 C.3 1 noname -0.0160 11 C8 1.4771 0.9959 1.8218 C.2 1 noname -0.0049 12 C9 -0.6471 2.2204 1.6378 C.2 1 noname -0.0049 13 C10 0.6883 2.1241 2.1225 C.2 1 noname 0.0234 14 H1 -0.0721 -0.0353 -2.2725 H 1 noname 0.0492 15 H2 -1.9136 -0.7098 -0.6604 H 1 noname 0.0668 16 H3 1.9996 -0.5940 -1.2949 H 1 noname 0.0247 17 H4 1.5181 -2.3039 -1.1065 H 1 noname 0.0247 18 H5 1.7855 -1.5916 -2.7337 H 1 noname 0.0247 19 H6 -0.6221 -2.9597 -2.2645 H 1 noname 0.1222 20 H7 1.4472 -0.9084 0.9929 H 1 noname 0.0627 21 H8 -2.1293 1.3068 0.4377 H 1 noname 0.0627 22 H9 -1.3624 -2.8647 -0.3650 H 1 noname 0.2109 23 H10 -2.3107 -2.6434 -3.8938 H 1 noname 0.0391 24 H11 -2.7348 -1.7360 -2.4224 H 1 noname 0.0391 25 H12 -2.0413 -0.8853 -3.8237 H 1 noname 0.0391 26 H13 2.4605 0.9342 2.0943 H 1 noname 0.0653 27 H14 -1.2488 2.9958 1.9209 H 1 noname 0.0653 @BOND 1 1 13 1 2 5 2 1 3 2 22 1 4 4 3 1 5 3 10 1 6 3 19 1 7 4 5 1 8 4 7 1 9 4 14 1 10 5 6 1 11 5 15 1 12 6 8 2 13 6 9 1 14 7 16 1 15 7 17 1 16 7 18 1 17 8 11 1 18 8 20 1 19 9 12 2 20 9 21 1 21 10 23 1 22 10 24 1 23 10 25 1 24 11 13 2 25 11 26 1 26 12 13 1 27 12 27 1 @SUBSTRUCTURE 1 noname 1