@MOLECULE FDBD01525 41 41 0 0 0 SMALL GASTEIGER @ATOM 1 Cl 0.8313 0.7603 2.7042 Cl 1 UNK -0.0798 2 O -1.6254 -3.1525 0.7334 O.3 1 UNK -0.3831 3 O1 0.5147 -1.3378 0.5735 O.3 1 UNK -0.4877 4 N -2.3846 0.0841 -0.8884 N.4 1 UNK 0.2327 5 C -3.1472 1.2481 -0.4253 C.3 1 UNK -0.0203 6 C1 -2.3479 -0.9437 0.1381 C.3 1 UNK -0.0033 7 C2 -1.5558 -2.1749 -0.3085 C.3 1 UNK 0.1285 8 C3 -3.1659 2.2960 -1.5432 C.3 1 UNK -0.0193 9 C4 -4.5760 0.7985 -0.1021 C.3 1 UNK -0.0193 10 C5 -2.4806 1.8270 0.8283 C.3 1 UNK -0.0193 11 C6 -0.0871 -1.8747 -0.6003 C.3 1 UNK 0.1205 12 C7 1.5569 -0.4692 0.3884 C.ar 1 UNK 0.1391 13 C8 2.3602 -0.6251 -0.7377 C.ar 1 UNK -0.0156 14 C9 1.8133 0.5493 1.3017 C.ar 1 UNK 0.0825 15 C10 3.4289 0.2451 -0.9522 C.ar 1 UNK -0.0469 16 C11 3.6900 1.2673 -0.0399 C.ar 1 UNK -0.0572 17 C12 2.8824 1.4193 1.0871 C.ar 1 UNK -0.0396 18 C13 4.2929 0.0828 -2.1570 C.3 1 UNK -0.0396 19 H -2.5545 -3.3519 0.9281 H 1 UNK 0.2102 20 H1 -1.4313 0.3733 -1.1076 H 1 UNK 0.2020 21 H2 -2.8373 -0.2966 -1.7193 H 1 UNK 0.2020 22 H3 -3.3504 -1.2417 0.3641 H 1 UNK 0.0841 23 H4 -1.8618 -0.5332 0.9984 H 1 UNK 0.0841 24 H5 -1.9912 -2.5245 -1.2212 H 1 UNK 0.0681 25 H6 -3.6328 1.8820 -2.4124 H 1 UNK 0.0287 26 H7 -2.1627 2.5831 -1.7798 H 1 UNK 0.0287 27 H8 -3.7154 3.1546 -1.2180 H 1 UNK 0.0287 28 H9 -5.0313 0.3966 -0.9830 H 1 UNK 0.0287 29 H10 -5.1444 1.6370 0.2424 H 1 UNK 0.0287 30 H11 -4.5499 0.0479 0.6601 H 1 UNK 0.0287 31 H12 -1.4844 2.1375 0.5914 H 1 UNK 0.0287 32 H13 -2.4489 1.0792 1.5930 H 1 UNK 0.0287 33 H14 -3.0434 2.6683 1.1753 H 1 UNK 0.0287 34 H15 0.4152 -2.7767 -0.8813 H 1 UNK 0.0725 35 H16 -0.0129 -1.1694 -1.4015 H 1 UNK 0.0725 36 H17 2.1656 -1.3821 -1.4116 H 1 UNK 0.0657 37 H18 4.4807 1.9112 -0.1987 H 1 UNK 0.0621 38 H19 3.0758 2.1755 1.7623 H 1 UNK 0.0633 39 H20 3.9444 -0.7462 -2.7368 H 1 UNK 0.0278 40 H21 5.3024 -0.0956 -1.8505 H 1 UNK 0.0278 41 H22 4.2518 0.9738 -2.7481 H 1 UNK 0.0278 @BOND 1 1 14 1 2 2 7 1 3 3 11 1 4 3 12 1 5 4 5 1 6 4 6 1 7 5 8 1 8 5 9 1 9 5 10 1 10 6 7 1 11 7 11 1 12 12 13 ar 13 12 14 ar 14 13 15 ar 15 14 17 ar 16 15 16 ar 17 15 18 1 18 16 17 ar 19 2 19 1 20 4 20 1 21 4 21 1 22 6 22 1 23 6 23 1 24 7 24 1 25 8 25 1 26 8 26 1 27 8 27 1 28 9 28 1 29 9 29 1 30 9 30 1 31 10 31 1 32 10 32 1 33 10 33 1 34 11 34 1 35 11 35 1 36 13 36 1 37 16 37 1 38 17 38 1 39 18 39 1 40 18 40 1 41 18 41 1