@MOLECULE FDBD01715 52 53 0 0 0 SMALL GASTEIGER @ATOM 1 F -4.1700 -3.4352 -0.4537 F 1 UNK -0.2467 2 O -5.4761 0.9901 0.5632 O.3 1 UNK -0.3742 3 O1 -3.2422 1.8109 -0.8812 O.3 1 UNK -0.4897 4 O2 -6.1947 -1.6920 0.2200 O.3 1 UNK -0.3750 5 N 8.4480 -0.9935 0.4091 N.pl3 1 UNK -0.3469 6 C -5.3759 2.3255 0.0835 C.3 1 UNK 0.0818 7 C1 -3.9120 2.7124 -0.0011 C.3 1 UNK 0.1128 8 C2 0.7673 1.1150 -0.1679 C.ar 1 UNK -0.0248 9 C3 -6.8306 0.5730 0.6628 C.3 1 UNK 0.0711 10 C4 -1.9214 1.5821 -0.6462 C.ar 1 UNK 0.1206 11 C5 -6.8719 -0.8609 1.1549 C.3 1 UNK 0.0711 12 C6 4.3589 -0.3225 -0.2761 C.ar 1 UNK -0.0249 13 C7 -0.0033 0.1160 -0.7396 C.ar 1 UNK -0.0511 14 C8 0.2216 2.3429 0.1697 C.ar 1 UNK -0.0511 15 C9 -1.3570 0.3510 -0.9806 C.ar 1 UNK -0.0194 16 C10 -1.1321 2.5781 -0.0711 C.ar 1 UNK -0.0194 17 C11 2.1974 0.8675 0.0872 C.2 1 UNK -0.0540 18 C12 2.9429 -0.0902 -0.5134 C.2 1 UNK -0.0540 19 C13 7.0750 -0.7683 0.1790 C.ar 1 UNK 0.0269 20 C14 5.1169 -1.0249 -1.2130 C.ar 1 UNK -0.0529 21 C15 4.9587 0.1569 0.8883 C.ar 1 UNK -0.0529 22 C16 6.4750 -1.2477 -0.9856 C.ar 1 UNK -0.0403 23 C17 6.3167 -0.0658 1.1157 C.ar 1 UNK -0.0403 24 C18 -6.2022 -3.0519 0.6315 C.3 1 UNK 0.0759 25 C19 -5.4569 -3.8754 -0.3947 C.3 1 UNK 0.1134 26 C20 9.2679 -0.0931 1.1591 C.3 1 UNK -0.0024 27 H 8.8603 -1.8064 0.0370 H 1 UNK 0.1457 28 H1 -5.8833 2.9866 0.7547 H 1 UNK 0.0594 29 H2 -5.8245 2.3957 -0.8854 H 1 UNK 0.0594 30 H3 -3.8261 3.7106 -0.3769 H 1 UNK 0.0720 31 H4 -3.4689 2.6634 0.9716 H 1 UNK 0.0720 32 H5 -7.2967 0.6358 -0.2983 H 1 UNK 0.0583 33 H6 -7.3536 1.2055 1.3493 H 1 UNK 0.0583 34 H7 -6.3902 -0.9269 2.1081 H 1 UNK 0.0583 35 H8 -7.8885 -1.1803 1.2518 H 1 UNK 0.0583 36 H9 0.4197 -0.7928 -0.9847 H 1 UNK 0.0625 37 H10 0.8105 3.0760 0.5949 H 1 UNK 0.0625 38 H11 -1.9409 -0.3858 -1.4062 H 1 UNK 0.0654 39 H12 -1.5496 3.4889 0.1762 H 1 UNK 0.0654 40 H13 2.6682 1.4721 0.7785 H 1 UNK 0.0624 41 H14 2.4685 -0.7042 -1.1938 H 1 UNK 0.0624 42 H15 4.6729 -1.3797 -2.0744 H 1 UNK 0.0624 43 H16 4.3978 0.6763 1.5815 H 1 UNK 0.0624 44 H17 7.0359 -1.7672 -1.6789 H 1 UNK 0.0636 45 H18 6.7606 0.2892 1.9771 H 1 UNK 0.0636 46 H19 -7.2114 -3.3992 0.7072 H 1 UNK 0.0585 47 H20 -5.7286 -3.1455 1.5864 H 1 UNK 0.0585 48 H21 -5.4724 -4.9066 -0.1095 H 1 UNK 0.0638 49 H22 -5.9222 -3.7736 -1.3528 H 1 UNK 0.0638 50 H23 8.6767 0.7342 1.4923 H 1 UNK 0.0425 51 H24 10.0642 0.2640 0.5400 H 1 UNK 0.0425 52 H25 9.6762 -0.6038 2.0061 H 1 UNK 0.0425 @BOND 1 1 25 1 2 2 6 1 3 2 9 1 4 3 7 1 5 3 10 1 6 4 11 1 7 4 24 1 8 5 19 1 9 5 26 1 10 6 7 1 11 8 13 ar 12 8 14 ar 13 8 17 1 14 9 11 1 15 10 15 ar 16 10 16 ar 17 12 18 1 18 12 20 ar 19 12 21 ar 20 13 15 ar 21 14 16 ar 22 17 18 2 23 19 22 ar 24 19 23 ar 25 20 22 ar 26 21 23 ar 27 24 25 1 28 5 27 1 29 6 28 1 30 6 29 1 31 7 30 1 32 7 31 1 33 9 32 1 34 9 33 1 35 11 34 1 36 11 35 1 37 13 36 1 38 14 37 1 39 15 38 1 40 16 39 1 41 17 40 1 42 18 41 1 43 20 42 1 44 21 43 1 45 22 44 1 46 23 45 1 47 24 46 1 48 24 47 1 49 25 48 1 50 25 49 1 51 26 50 1 52 26 51 1 53 26 52 1