@MOLECULE perfluorohexylbromide 20 19 0 0 0 SMALL GASTEIGER @ATOM 1 BR -3.1459 -0.5913 -0.0223 Br 1 UNL1111111111 0.0201 2 F 0.9371 0.4848 1.9558 F 1 UNL1111111111 -0.1291 3 F -0.7360 -0.7842 1.8786 F 1 UNL1111111111 -0.1259 4 F 1.4587 -1.9785 0.9427 F 1 UNL1111111111 -0.1237 5 F 0.0002 -1.7671 -0.5562 F 1 UNL1111111111 -0.1301 6 F 0.1093 1.9466 -0.1334 F 1 UNL1111111111 -0.1328 7 F -1.3663 1.7698 1.3549 F 1 UNL1111111111 -0.1248 8 F 1.3579 0.3876 -1.6477 F 1 UNL1111111111 -0.1271 9 F 2.4674 -1.3969 -1.5323 F 1 UNL1111111111 -0.1181 10 F -1.1932 0.1006 -1.7266 F 1 UNL1111111111 -0.1453 11 F -2.4043 1.7200 -1.1477 F 1 UNL1111111111 -0.1352 12 F 3.5345 -0.3316 1.0266 F 1 UNL1111111111 -0.1542 13 F 2.7263 1.5259 0.3818 F 1 UNL1111111111 -0.1524 14 F 4.1535 0.5131 -0.8224 F 1 UNL1111111111 -0.1451 15 C 0.0793 -0.0727 1.0979 C.3 1 UNL1111111111 0.2491 16 C 0.8673 -1.0624 0.1726 C.3 1 UNL1111111111 0.2512 17 C -0.7411 1.0697 0.4055 C.3 1 UNL1111111111 0.2475 18 C 1.9425 -0.4329 -0.7752 C.3 1 UNL1111111111 0.2384 19 C -1.7914 0.6421 -0.6715 C.3 1 UNL1111111111 0.2773 20 C 3.1014 0.3261 -0.0399 C.3 1 UNL1111111111 0.4602 @BOND 1 1 19 1 2 2 15 1 3 3 15 1 4 4 16 1 5 5 16 1 6 6 17 1 7 7 17 1 8 8 18 1 9 9 18 1 10 10 19 1 11 11 19 1 12 12 20 1 13 13 20 1 14 14 20 1 15 15 16 1 16 15 17 1 17 16 18 1 18 17 19 1 19 18 20 1