# created with PyMOL 3.1.0 @MOLECULE 20230403_Murase_F4-thia6-SO2_100K_auto 41 46 1 SMALL USER_CHARGES @ATOM 1 C1 0.328 8.822 9.810 C.2 1 UNK1 0.000 2 O1 2.309 11.461 6.814 O.2 1 UNK1 0.000 3 S1 1.279 10.460 6.749 S.o2 1 UNK1 0.000 4 C2 0.264 7.467 9.638 C.2 1 UNK1 0.000 5 O2 1.615 9.123 7.170 O.2 1 UNK1 0.000 6 C3 1.426 6.697 9.609 C.2 1 UNK1 0.000 7 C4 2.622 7.313 9.822 C.2 1 UNK1 0.000 8 C5 2.722 8.702 10.010 C.2 1 UNK1 0.000 9 C6 3.980 9.292 10.330 C.2 1 UNK1 0.000 10 C7 4.036 10.596 10.688 C.2 1 UNK1 0.000 11 C8 2.886 11.437 10.626 C.2 1 UNK1 0.000 12 C9 2.932 12.748 11.170 C.3 1 UNK1 0.000 13 C10 1.803 13.500 11.243 C.3 1 UNK1 0.000 14 C11 0.627 13.090 10.550 C.2 1 UNK1 0.000 15 C12 -0.557 13.885 10.621 C.2 1 UNK1 0.000 16 C13 -1.642 13.585 9.873 C.2 1 UNK1 0.000 17 C14 -1.552 12.592 8.848 C.2 1 UNK1 0.000 18 C15 -2.594 12.467 7.902 C.2 1 UNK1 0.000 19 C16 -2.433 11.736 6.752 C.2 1 UNK1 0.000 20 C17 -1.188 11.137 6.519 C.2 1 UNK1 0.000 21 C18 -0.746 10.614 5.216 C.3 1 UNK1 0.000 22 C19 0.541 10.304 5.154 C.3 1 UNK1 0.000 23 C20 -0.209 11.116 7.505 C.2 1 UNK1 0.000 24 C21 -0.364 11.805 8.731 C.2 1 UNK1 0.000 25 C22 0.638 11.907 9.781 C.2 1 UNK1 0.000 26 C23 1.680 10.949 10.060 C.2 1 UNK1 0.000 27 C24 1.551 9.513 9.922 C.2 1 UNK1 0.000 28 F1 -0.852 9.468 9.894 F 1 UNK1 0.000 29 F2 -0.928 6.860 9.507 F 1 UNK1 0.000 30 F3 1.338 5.376 9.419 F 1 UNK1 0.000 31 F4 3.738 6.562 9.877 F 1 UNK1 0.000 32 H6 4.755 8.720 10.337 H 1 UNK1 0.000 33 H7 4.882 10.987 11.006 H 1 UNK1 0.000 34 H9 3.749 13.032 11.560 H 1 UNK1 0.000 35 H10 1.778 14.337 11.728 H 1 UNK1 0.000 36 H12 -0.556 14.615 11.253 H 1 UNK1 0.000 37 H13 -2.456 14.114 9.920 H 1 UNK1 0.000 38 H15 -3.409 12.947 8.082 H 1 UNK1 0.000 39 H16 -3.131 11.683 6.111 H 1 UNK1 0.000 40 H18 -1.387 10.541 4.494 H 1 UNK1 0.000 41 H19 1.066 9.954 4.468 H 1 UNK1 0.000 @BOND 1 1 4 ar 2 1 27 ar 3 1 28 1 4 2 3 2 5 3 5 2 6 3 23 1 7 4 6 ar 8 4 29 1 9 6 7 ar 10 6 30 1 11 7 8 ar 12 7 31 1 13 8 9 ar 14 8 27 ar 15 9 10 ar 16 9 32 1 17 10 11 ar 18 10 33 1 19 11 12 1 20 11 26 ar 21 12 13 1 22 12 34 1 23 13 14 1 24 13 35 1 25 14 15 ar 26 14 25 ar 27 15 16 ar 28 15 36 1 29 16 17 ar 30 16 37 1 31 17 18 ar 32 17 24 ar 33 18 19 ar 34 18 38 1 35 19 20 ar 36 19 39 1 37 20 21 1 38 20 23 ar 39 21 22 1 40 21 40 1 41 3 22 1 42 22 41 1 43 23 24 ar 44 24 25 ar 45 25 26 ar 46 26 27 ar @SUBSTRUCTURE 1 UNK1 1 GROUP 1 **** UNK