@MOLECULE FDBD02139 40 41 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.2794 0.7151 -1.4411 C.3 1 UNK -0.0411 2 C1 -0.3738 -0.7589 -1.0418 C.3 1 UNK 0.0525 3 O 0.7016 -1.4845 -1.6411 O.3 1 UNK -0.3236 4 P 0.9623 -3.0497 -1.3688 P.3 1 UNK 0.2309 5 S -0.6570 -3.9697 -1.4340 S.2 1 UNK 0.0032 6 O1 1.9559 -3.6319 -2.4940 O.3 1 UNK -0.3236 7 C2 2.1388 -5.0306 -2.7224 C.3 1 UNK 0.0525 8 C3 3.1457 -5.2348 -3.8561 C.3 1 UNK -0.0411 9 S1 1.8394 -3.2976 0.5452 S.3 1 UNK -0.0496 10 C4 0.6866 -2.4226 1.6388 C.3 1 UNK 0.1018 11 C5 -0.6446 -3.1756 1.6839 C.3 1 UNK 0.0514 12 Cl -0.3474 -4.8951 2.1374 Cl 1 UNK -0.1226 13 N 1.2528 -2.3505 2.9880 N.am 1 UNK -0.2198 14 C6 1.9707 -3.3307 3.5656 C.2 1 UNK 0.2548 15 O2 2.2474 -4.3993 3.0593 O.2 1 UNK -0.2695 16 C7 2.3664 -2.8893 4.9197 C.ar 1 UNK 0.0494 17 C8 3.0946 -3.4622 5.9500 C.ar 1 UNK -0.0489 18 C9 3.2887 -2.7585 7.1283 C.ar 1 UNK -0.0610 19 C10 2.7611 -1.4901 7.2820 C.ar 1 UNK -0.0610 20 C11 2.0306 -0.9044 6.2599 C.ar 1 UNK -0.0489 21 C12 1.8284 -1.5960 5.0764 C.ar 1 UNK 0.0494 22 C13 1.1281 -1.2932 3.8103 C.2 1 UNK 0.2548 23 O3 0.5378 -0.2628 3.5557 O.2 1 UNK -0.2695 24 H -1.0846 1.2584 -0.9924 H 1 UNK 0.0252 25 H1 -0.3410 0.8008 -2.5059 H 1 UNK 0.0252 26 H2 0.6534 1.1168 -1.1043 H 1 UNK 0.0252 27 H3 -1.3066 -1.1607 -1.3786 H 1 UNK 0.0561 28 H4 -0.3123 -0.8447 0.0230 H 1 UNK 0.0561 29 H5 1.2029 -5.4733 -2.9926 H 1 UNK 0.0561 30 H6 2.5075 -5.4925 -1.8304 H 1 UNK 0.0561 31 H7 2.7770 -4.7729 -4.7481 H 1 UNK 0.0252 32 H8 3.2827 -6.2821 -4.0272 H 1 UNK 0.0252 33 H9 4.0816 -4.7921 -3.5859 H 1 UNK 0.0252 34 H10 0.5240 -1.4326 1.2669 H 1 UNK 0.0637 35 H11 -1.1096 -3.1359 0.7210 H 1 UNK 0.0457 36 H12 -1.2869 -2.7214 2.4092 H 1 UNK 0.0457 37 H13 3.4908 -4.4088 5.8405 H 1 UNK 0.0625 38 H14 3.8309 -3.1845 7.8962 H 1 UNK 0.0618 39 H15 2.9121 -0.9757 8.1638 H 1 UNK 0.0618 40 H16 1.6390 0.0428 6.3799 H 1 UNK 0.0625 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 2 5 4 6 1 6 4 9 1 7 6 7 1 8 7 8 1 9 9 10 1 10 10 11 1 11 10 13 1 12 11 12 1 13 13 22 am 14 13 14 am 15 14 15 2 16 14 16 1 17 16 21 ar 18 16 17 ar 19 17 18 ar 20 18 19 ar 21 19 20 ar 22 20 21 ar 23 21 22 1 24 22 23 2 25 1 24 1 26 1 25 1 27 1 26 1 28 2 27 1 29 2 28 1 30 7 29 1 31 7 30 1 32 8 31 1 33 8 32 1 34 8 33 1 35 10 34 1 36 11 35 1 37 11 36 1 38 17 37 1 39 18 38 1 40 19 39 1 41 20 40 1