@MOLECULE 76963284 31 31 1 SMALL USER_CHARGES @ATOM 1 F1 2.8839 3.4744 1.2700 F 1 noname -0.1660 2 F2 2.7614 4.1774 -0.8623 F 1 noname -0.1660 3 F3 1.4221 4.9870 0.5736 F 1 noname -0.1660 4 O1 1.9502 -0.6586 -1.6532 O.3 1 noname -0.2784 5 O2 -0.9776 3.5401 0.5794 O.3 1 noname -0.2723 6 N1 -1.6434 -3.1742 -0.6530 N.3 1 noname -0.3301 7 C1 -0.1783 0.2758 -0.9161 C.2 1 noname -0.0137 8 C2 -0.9130 -0.9317 -1.3342 C.3 1 noname 0.0266 9 C3 1.2181 0.3658 -1.1012 C.2 1 noname -0.0078 10 C4 1.2093 2.6165 -0.0860 C.2 1 noname 0.0180 11 C5 -0.8775 1.3445 -0.3305 C.2 1 noname -0.0152 12 C6 -0.1987 2.5010 0.1141 C.2 1 noname 0.0195 13 C7 1.8864 1.5236 -0.6548 C.2 1 noname 0.0114 14 C8 -0.9390 -1.9762 -0.2080 C.3 1 noname -0.0035 15 C9 2.0289 3.8177 0.2440 C.3 1 noname 0.4187 16 C10 2.0476 -0.5208 -3.0835 C.3 1 noname 0.0423 17 C11 -0.8817 3.7308 2.0038 C.3 1 noname 0.0423 18 H1 -1.9342 -0.6610 -1.6024 H 1 noname 0.0330 19 H2 -0.4099 -1.4189 -2.1695 H 1 noname 0.0330 20 H3 -1.8829 1.2952 -0.2332 H 1 noname 0.0654 21 H4 2.8865 1.5495 -0.7750 H 1 noname 0.0657 22 H5 -1.4453 -1.5593 0.6626 H 1 noname 0.0429 23 H6 0.0836 -2.2417 0.0603 H 1 noname 0.0429 24 H7 -1.6555 -3.8626 0.1023 H 1 noname 0.1184 25 H8 -2.6028 -2.9306 -0.9072 H 1 noname 0.1184 26 H9 2.6325 -1.3463 -3.4890 H 1 noname 0.0535 27 H10 1.0484 -0.5350 -3.5188 H 1 noname 0.0535 28 H11 2.5357 0.4234 -3.3250 H 1 noname 0.0535 29 H12 -1.5189 4.5631 2.3027 H 1 noname 0.0535 30 H13 -1.2055 2.8238 2.5144 H 1 noname 0.0535 31 H14 0.1517 3.9497 2.2724 H 1 noname 0.0535 @BOND 1 1 15 1 2 2 15 1 3 3 15 1 4 4 9 1 5 4 16 1 6 5 12 1 7 5 17 1 8 6 14 1 9 6 24 1 10 6 25 1 11 7 8 1 12 7 9 1 13 7 11 2 14 8 14 1 15 8 18 1 16 8 19 1 17 9 13 2 18 10 12 2 19 10 13 1 20 10 15 1 21 11 12 1 22 11 20 1 23 13 21 1 24 14 22 1 25 14 23 1 26 16 26 1 27 16 27 1 28 16 28 1 29 17 29 1 30 17 30 1 31 17 31 1 @SUBSTRUCTURE 1 noname 1