@MOLECULE FDBD02409 47 47 0 0 0 SMALL GASTEIGER @ATOM 1 C 18.8747 -0.7218 -6.7674 C.3 1 UNK -0.0652 2 C1 17.4785 -0.5516 -6.1925 C.3 1 UNK -0.0538 3 C2 17.2412 -1.4559 -4.9834 C.3 1 UNK -0.0296 4 C3 15.8568 -1.2181 -4.3908 C.3 1 UNK 0.0497 5 O 15.6164 -2.1501 -3.3362 O.3 1 UNK -0.3610 6 C4 14.3711 -1.8638 -2.6996 C.3 1 UNK 0.1203 7 N 14.1935 -2.7688 -1.5772 N.am 1 UNK -0.2462 8 C5 14.8567 -2.4662 -0.3786 C.2 1 UNK 0.2362 9 O1 15.6220 -1.5047 -0.2891 O.2 1 UNK -0.2739 10 C6 14.5626 -3.3961 0.7981 C.3 1 UNK 0.0995 11 Cl 15.4665 -2.9207 2.2557 Cl 1 UNK -0.1156 12 C7 13.0346 -3.5885 -1.5941 C.ar 1 UNK 0.0448 13 C8 11.7617 -3.0359 -1.3108 C.ar 1 UNK -0.0259 14 C9 11.5307 -1.5725 -0.9928 C.3 1 UNK -0.0288 15 C10 10.7726 -0.8466 -2.0973 C.3 1 UNK -0.0612 16 C11 10.6443 -3.8880 -1.2994 C.ar 1 UNK -0.0568 17 C12 10.7771 -5.2475 -1.5627 C.ar 1 UNK -0.0611 18 C13 12.0301 -5.7820 -1.8443 C.ar 1 UNK -0.0568 19 C14 13.1746 -4.9670 -1.8666 C.ar 1 UNK -0.0259 20 C15 14.5005 -5.6134 -2.2069 C.3 1 UNK -0.0288 21 C16 14.6353 -5.8900 -3.6971 C.3 1 UNK -0.0612 22 H 18.9956 -0.0719 -7.6088 H 1 UNK 0.0230 23 H1 19.0112 -1.7366 -7.0780 H 1 UNK 0.0230 24 H2 19.6004 -0.4768 -6.0202 H 1 UNK 0.0230 25 H3 16.7618 -0.7925 -6.9496 H 1 UNK 0.0263 26 H4 17.3760 0.4636 -5.8703 H 1 UNK 0.0263 27 H5 17.9814 -1.2477 -4.2394 H 1 UNK 0.0287 28 H6 17.3072 -2.4757 -5.3005 H 1 UNK 0.0287 29 H7 15.1171 -1.3457 -5.1533 H 1 UNK 0.0560 30 H8 15.8049 -0.2227 -4.0017 H 1 UNK 0.0560 31 H9 13.5720 -1.9981 -3.3984 H 1 UNK 0.0775 32 H10 14.3677 -0.8520 -2.3516 H 1 UNK 0.0775 33 H11 14.8392 -4.3940 0.5288 H 1 UNK 0.0525 34 H12 13.5175 -3.3338 1.0190 H 1 UNK 0.0525 35 H13 12.4797 -1.0968 -0.8585 H 1 UNK 0.0311 36 H14 10.9360 -1.5233 -0.1046 H 1 UNK 0.0311 37 H15 11.3433 -0.8783 -3.0019 H 1 UNK 0.0233 38 H16 10.6142 0.1722 -1.8111 H 1 UNK 0.0233 39 H17 9.8280 -1.3239 -2.2546 H 1 UNK 0.0233 40 H18 9.7110 -3.4993 -1.0925 H 1 UNK 0.0621 41 H19 9.9462 -5.8594 -1.5491 H 1 UNK 0.0618 42 H20 12.1204 -6.7913 -2.0396 H 1 UNK 0.0621 43 H21 14.5800 -6.5387 -1.6754 H 1 UNK 0.0311 44 H22 15.2797 -4.9364 -1.9251 H 1 UNK 0.0311 45 H23 13.8657 -6.5664 -4.0054 H 1 UNK 0.0233 46 H24 15.5927 -6.3255 -3.8939 H 1 UNK 0.0233 47 H25 14.5424 -4.9726 -4.2400 H 1 UNK 0.0233 @BOND 1 12 13 ar 2 13 16 ar 3 12 19 ar 4 18 19 ar 5 17 18 ar 6 16 17 ar 7 1 2 1 8 2 3 1 9 3 4 1 10 4 5 1 11 5 6 1 12 6 7 1 13 7 12 1 14 13 14 1 15 14 15 1 16 19 20 1 17 20 21 1 18 7 8 am 19 8 10 1 20 10 11 1 21 8 9 2 22 1 22 1 23 1 23 1 24 1 24 1 25 2 25 1 26 2 26 1 27 3 27 1 28 3 28 1 29 4 29 1 30 4 30 1 31 6 31 1 32 6 32 1 33 10 33 1 34 10 34 1 35 14 35 1 36 14 36 1 37 15 37 1 38 15 38 1 39 15 39 1 40 16 40 1 41 17 41 1 42 18 42 1 43 20 43 1 44 20 44 1 45 21 45 1 46 21 46 1 47 21 47 1