@MOLECULE FDBD00963 39 40 0 0 0 SMALL GASTEIGER @ATOM 1 Cl 5.7083 0.2573 -0.1519 Cl 1 UNK -0.0835 2 N -2.8264 1.9860 -0.2817 N.4 1 UNK 0.2309 3 N1 -0.6102 -1.6817 1.0496 N.ar 1 UNK -0.2593 4 C -0.2901 0.4470 -0.0598 C.3 1 UNK 0.0312 5 C1 -0.8534 1.3785 1.0454 C.3 1 UNK -0.0003 6 C2 -2.3831 1.4734 1.0104 C.3 1 UNK -0.0315 7 C3 1.2348 0.3991 -0.0837 C.ar 1 UNK -0.0382 8 C4 -0.8856 -0.9551 -0.0400 C.ar 1 UNK 0.0488 9 C5 1.8728 0.1734 -1.2841 C.ar 1 UNK -0.0566 10 C6 1.9221 0.5834 1.0964 C.ar 1 UNK -0.0566 11 C7 -1.6388 -1.3543 -1.1136 C.ar 1 UNK -0.0398 12 C8 -2.3060 3.3354 -0.5060 C.3 1 UNK -0.0433 13 C9 -4.2878 1.9849 -0.3618 C.3 1 UNK -0.0433 14 C10 3.2668 0.1298 -1.3055 C.ar 1 UNK -0.0431 15 C11 3.3161 0.5399 1.0749 C.ar 1 UNK -0.0431 16 C12 -2.1678 -2.6392 -1.0645 C.ar 1 UNK -0.0586 17 C13 3.9885 0.3130 -0.1260 C.ar 1 UNK 0.0410 18 C14 -1.1411 -2.9249 1.0617 C.ar 1 UNK 0.0279 19 C15 -1.9190 -3.4459 0.0403 C.ar 1 UNK -0.0436 20 H -2.4616 1.3729 -1.0107 H 1 UNK 0.2028 21 H1 -0.6068 0.9003 -0.9758 H 1 UNK 0.0414 22 H2 -0.4457 2.3583 0.9089 H 1 UNK 0.0326 23 H3 -0.5751 0.9647 1.9921 H 1 UNK 0.0326 24 H4 -2.8013 0.5011 1.1673 H 1 UNK 0.0814 25 H5 -2.7094 2.1400 1.7812 H 1 UNK 0.0814 26 H6 1.3294 0.0391 -2.1511 H 1 UNK 0.0621 27 H7 1.4149 0.7505 1.9795 H 1 UNK 0.0621 28 H8 -1.8051 -0.7312 -1.9193 H 1 UNK 0.0636 29 H9 -2.6798 3.9923 0.2514 H 1 UNK 0.0777 30 H10 -2.6208 3.6839 -1.4674 H 1 UNK 0.0777 31 H11 -1.2369 3.3166 -0.4660 H 1 UNK 0.0777 32 H12 -4.6871 2.6244 0.3975 H 1 UNK 0.0777 33 H13 -4.6522 0.9893 -0.2175 H 1 UNK 0.0777 34 H14 -4.5925 2.3403 -1.3240 H 1 UNK 0.0777 35 H15 3.7642 -0.0380 -2.1940 H 1 UNK 0.0632 36 H16 3.8501 0.6756 1.9475 H 1 UNK 0.0632 37 H17 -2.7429 -2.9928 -1.8451 H 1 UNK 0.0619 38 H18 -0.9556 -3.5227 1.8822 H 1 UNK 0.0829 39 H19 -2.3017 -4.4026 0.0977 H 1 UNK 0.0633 @BOND 1 1 17 1 2 2 6 1 3 2 12 1 4 2 13 1 5 3 8 ar 6 3 18 ar 7 4 5 1 8 4 7 1 9 4 8 1 10 5 6 1 11 7 9 ar 12 7 10 ar 13 8 11 ar 14 9 14 ar 15 10 15 ar 16 11 16 ar 17 14 17 ar 18 15 17 ar 19 16 19 ar 20 18 19 ar 21 2 20 1 22 4 21 1 23 5 22 1 24 5 23 1 25 6 24 1 26 6 25 1 27 9 26 1 28 10 27 1 29 11 28 1 30 12 29 1 31 12 30 1 32 12 31 1 33 13 32 1 34 13 33 1 35 13 34 1 36 14 35 1 37 15 36 1 38 16 37 1 39 18 38 1 40 19 39 1