@MOLECULE FDBD01929 37 36 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0187 1.5258 0.0104 C.3 1 UNK -0.0510 2 C1 0.0021 -0.0041 0.0020 C.3 1 UNK 0.0145 3 N 0.6878 -0.4765 -1.2033 N.3 1 UNK -0.1890 4 S 1.1892 -2.0514 -1.3071 S.O2 1 UNK 0.1009 5 O 1.8214 -2.1348 -2.5770 O.2 1 UNK -0.1522 6 O1 1.9218 -2.2656 -0.1085 O.2 1 UNK -0.1522 7 C2 -0.3464 -3.0170 -1.2959 C.3 1 UNK 0.4443 8 C3 -0.0124 -4.5072 -1.3884 C.3 1 UNK 0.3999 9 C4 -1.3076 -5.3217 -1.3789 C.3 1 UNK 0.3857 10 C5 -0.9736 -6.8119 -1.4715 C.3 1 UNK 0.3841 11 C6 -2.2688 -7.6264 -1.4620 C.3 1 UNK 0.3841 12 C7 -1.9348 -9.1166 -1.5545 C.3 1 UNK 0.3868 13 C8 -3.2300 -9.9311 -1.5450 C.3 1 UNK 0.4087 14 C9 -2.8960 -11.4213 -1.6375 C.3 1 UNK 0.4603 15 F -2.1049 -11.7906 -0.5445 F 1 UNK -0.1648 16 F1 -4.0803 -12.1660 -1.6289 F 1 UNK -0.1648 17 F2 -2.1975 -11.6699 -2.8239 F 1 UNK -0.1648 18 F3 -3.9285 -9.6825 -0.3586 F 1 UNK -0.1889 19 F4 -4.0212 -9.5617 -2.6381 F 1 UNK -0.1889 20 F5 -1.2363 -9.3652 -2.7409 F 1 UNK -0.1919 21 F6 -1.1437 -9.4860 -0.4614 F 1 UNK -0.1919 22 F7 -2.9673 -7.3778 -0.2756 F 1 UNK -0.1920 23 F8 -3.0599 -7.2570 -2.5551 F 1 UNK -0.1920 24 F9 -0.2751 -7.0605 -2.6578 F 1 UNK -0.1920 25 F10 -0.1825 -7.1813 -0.3784 F 1 UNK -0.1920 26 F11 -2.0061 -5.0731 -0.1925 F 1 UNK -0.1919 27 F12 -2.0987 -4.9523 -2.4720 F 1 UNK -0.1919 28 F13 0.6861 -4.7558 -2.5748 F 1 UNK -0.1901 29 F14 0.7787 -4.8766 -0.2953 F 1 UNK -0.1901 30 F15 -1.0449 -2.7684 -0.1095 F 1 UNK -0.1726 31 F16 -1.1375 -2.6476 -2.3890 F 1 UNK -0.1726 32 H -0.5195 1.8709 0.8907 H 1 UNK 0.0242 33 H1 -0.5362 1.8802 -0.8565 H 1 UNK 0.0242 34 H2 0.9851 1.8962 0.0028 H 1 UNK 0.0242 35 H3 -1.0017 -0.3745 0.0096 H 1 UNK 0.0438 36 H4 0.5196 -0.3585 0.8689 H 1 UNK 0.0438 37 H5 1.5181 0.1050 -1.3167 H 1 UNK 0.1478 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 2 5 4 6 2 6 4 7 1 7 7 8 1 8 7 30 1 9 7 31 1 10 8 9 1 11 8 28 1 12 8 29 1 13 9 10 1 14 9 26 1 15 9 27 1 16 10 11 1 17 10 24 1 18 10 25 1 19 11 12 1 20 11 22 1 21 11 23 1 22 12 13 1 23 12 20 1 24 12 21 1 25 13 14 1 26 13 18 1 27 13 19 1 28 14 15 1 29 14 16 1 30 14 17 1 31 1 32 1 32 1 33 1 33 1 34 1 34 2 35 1 35 2 36 1 36 3 37 1