@MOLECULE FDBD01895 31 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C 1.2526 -0.9494 -2.4866 C.3 1 UNK 0.0032 2 N 0.6122 -1.1926 -1.1916 N.am 1 UNK -0.2838 3 C1 -0.5783 -1.8221 -1.1363 C.2 1 UNK 0.4055 4 O -1.1203 -2.1879 -2.1605 O.2 1 UNK -0.2260 5 O1 -1.1669 -2.0457 0.0540 O.3 1 UNK -0.4078 6 C2 -2.4129 -2.5907 0.0339 C.ar 1 UNK 0.1747 7 C3 -3.5270 -1.7829 0.1973 C.ar 1 UNK -0.0155 8 C4 -4.7925 -2.3382 0.1762 C.ar 1 UNK -0.0581 9 C5 -4.9506 -3.6995 -0.0073 C.ar 1 UNK -0.0581 10 C6 -3.8436 -4.5112 -0.1704 C.ar 1 UNK -0.0161 11 C7 -2.5722 -3.9599 -0.1565 C.ar 1 UNK 0.1661 12 O2 -1.4822 -4.7568 -0.3172 O.3 1 UNK -0.4587 13 C8 -1.7094 -6.1672 -0.3538 C.3 1 UNK 0.2151 14 C9 -0.5718 -6.8473 -1.1181 C.3 1 UNK 0.0850 15 Cl 0.9939 -6.5121 -0.2892 Cl 1 UNK -0.1190 16 O3 -1.7582 -6.6766 0.9804 O.3 1 UNK -0.3440 17 C10 -2.9659 -6.3649 1.6778 C.3 1 UNK 0.0405 18 H 2.2002 -0.4333 -2.3320 H 1 UNK 0.0427 19 H1 1.4344 -1.9008 -2.9864 H 1 UNK 0.0427 20 H2 0.5999 -0.3330 -3.1047 H 1 UNK 0.0427 21 H3 1.0449 -0.9006 -0.3741 H 1 UNK 0.1517 22 H4 -3.4063 -0.7194 0.3415 H 1 UNK 0.0655 23 H5 -5.6599 -1.7075 0.3036 H 1 UNK 0.0619 24 H6 -5.9411 -4.1297 -0.0228 H 1 UNK 0.0619 25 H7 -3.9698 -5.5743 -0.3129 H 1 UNK 0.0655 26 H8 -2.6559 -6.3698 -0.8549 H 1 UNK 0.1068 27 H9 -0.7451 -7.9231 -1.1460 H 1 UNK 0.0491 28 H10 -0.5346 -6.4588 -2.1358 H 1 UNK 0.0491 29 H11 -3.0341 -5.2867 1.8223 H 1 UNK 0.0525 30 H12 -3.8208 -6.7082 1.0952 H 1 UNK 0.0525 31 H13 -2.9640 -6.8621 2.6478 H 1 UNK 0.0525 @BOND 1 1 2 1 2 1 18 1 3 1 19 1 4 1 20 1 5 2 3 am 6 2 21 1 7 3 4 2 8 3 5 1 9 5 6 1 10 6 11 ar 11 6 7 ar 12 7 8 ar 13 7 22 1 14 8 9 ar 15 8 23 1 16 9 10 ar 17 9 24 1 18 10 11 ar 19 10 25 1 20 11 12 1 21 12 13 1 22 13 14 1 23 13 16 1 24 13 26 1 25 14 15 1 26 14 27 1 27 14 28 1 28 16 17 1 29 17 29 1 30 17 30 1 31 17 31 1