@MOLECULE 76970572 18 18 1 SMALL USER_CHARGES @ATOM 1 F1 2.2830 -1.2500 3.6952 F 1 noname -0.2089 2 F2 3.1996 -2.3738 1.9895 F 1 noname -0.2089 3 O1 -0.2075 1.4288 -1.4465 O.3 1 noname -0.2044 4 O2 -1.0638 -0.1353 -3.0700 O.2 1 noname -0.2589 5 N1 2.2573 -0.4708 0.1876 N.3 1 noname -0.1482 6 C1 1.3394 0.0033 -0.6180 C.2 1 noname -0.0718 7 C2 1.7268 -0.5851 1.4890 C.3 1 noname 0.0609 8 C3 1.1102 1.3848 -0.8887 C.3 1 noname 0.0917 9 C4 0.4755 -0.7242 -1.3116 C.2 1 noname 0.0668 10 C5 2.7988 -1.1388 2.4298 C.3 1 noname 0.2509 11 C6 -0.3604 0.1506 -2.0771 C.2 1 noname 0.1028 12 H1 0.8717 -1.2609 1.4747 H 1 noname 0.0490 13 H2 1.4082 0.3967 1.8390 H 1 noname 0.0490 14 H3 1.1282 1.9460 0.0456 H 1 noname 0.0635 15 H4 1.8842 1.8288 -1.5147 H 1 noname 0.0635 16 H5 3.0182 0.1306 0.2002 H 1 noname 0.1281 17 H6 0.4175 -1.7124 -1.3019 H 1 noname 0.0700 18 H7 3.6539 -0.4631 2.4440 H 1 noname 0.1049 @BOND 1 1 10 1 2 2 10 1 3 3 8 1 4 3 11 1 5 4 11 2 6 5 6 1 7 5 7 1 8 5 16 1 9 6 8 1 10 6 9 2 11 7 10 1 12 7 12 1 13 7 13 1 14 8 14 1 15 8 15 1 16 9 11 1 17 9 17 1 18 10 18 1 @SUBSTRUCTURE 1 noname 1