@MOLECULE FDBD00099 37 37 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.4999 0.6269 1.9851 O.3 1 UNK -0.3855 2 O1 -0.7112 -2.5355 0.2463 O.3 1 UNK -0.4947 3 O2 -3.8818 1.9223 -0.4409 O.3 1 UNK -0.4951 4 O3 3.5067 -0.7490 -0.9943 O.2 1 UNK -0.2699 5 N 2.6092 1.0875 0.1083 N.am 1 UNK -0.3081 6 N1 6.0350 0.2337 -0.5674 N.4 1 UNK 0.2251 7 C 0.4700 0.0278 0.6895 C.3 1 UNK 0.0991 8 C1 -0.9730 -0.1533 0.2791 C.ar 1 UNK 0.0274 9 C2 1.2354 0.9042 -0.3022 C.3 1 UNK 0.0421 10 C3 -1.4842 -1.4258 0.0803 C.ar 1 UNK 0.1260 11 C4 -1.7612 0.9741 0.1084 C.ar 1 UNK -0.0108 12 C5 -3.0952 0.8246 -0.2711 C.ar 1 UNK 0.1207 13 C6 -2.8181 -1.5752 -0.2991 C.ar 1 UNK -0.0161 14 C7 -3.6237 -0.4501 -0.4749 C.ar 1 UNK -0.0165 15 C8 3.6377 0.2390 -0.2751 C.2 1 UNK 0.2582 16 C9 4.9651 0.6523 0.3268 C.3 1 UNK 0.0425 17 C10 -1.3076 -3.7971 0.0244 C.3 1 UNK 0.0788 18 C11 -3.3029 3.1935 -0.2232 C.3 1 UNK 0.0788 19 H 0.0134 0.0680 2.6111 H 1 UNK 0.2103 20 H1 2.8258 1.8525 0.6889 H 1 UNK 0.1490 21 H2 6.9348 0.5069 -0.1722 H 1 UNK 0.1999 22 H3 5.9130 0.6806 -1.4761 H 1 UNK 0.1999 23 H4 6.0068 -0.7796 -0.6803 H 1 UNK 0.1999 24 H5 0.9457 -0.9305 0.7035 H 1 UNK 0.0660 25 H6 1.2189 0.4371 -1.2647 H 1 UNK 0.0491 26 H7 0.7634 1.8638 -0.3382 H 1 UNK 0.0491 27 H8 -1.3650 1.9148 0.2606 H 1 UNK 0.0659 28 H9 -3.2091 -2.5183 -0.4498 H 1 UNK 0.0655 29 H10 -4.6106 -0.5608 -0.7557 H 1 UNK 0.0655 30 H11 4.9908 1.7154 0.4458 H 1 UNK 0.0911 31 H12 5.0898 0.1916 1.2844 H 1 UNK 0.0911 32 H13 -0.5844 -4.5678 0.1915 H 1 UNK 0.0660 33 H14 -1.6609 -3.8522 -0.9841 H 1 UNK 0.0660 34 H15 -2.1291 -3.9267 0.6977 H 1 UNK 0.0660 35 H16 -4.0367 3.9534 -0.3934 H 1 UNK 0.0660 36 H17 -2.4831 3.3321 -0.8967 H 1 UNK 0.0660 37 H18 -2.9508 3.2571 0.7852 H 1 UNK 0.0660 @BOND 1 1 7 1 2 2 10 1 3 2 17 1 4 3 12 1 5 3 18 1 6 4 15 2 7 5 9 1 8 5 15 am 9 6 16 1 10 7 8 1 11 7 9 1 12 8 10 ar 13 8 11 ar 14 10 13 ar 15 11 12 ar 16 12 14 ar 17 13 14 ar 18 15 16 1 19 1 19 1 20 5 20 1 21 6 21 1 22 6 22 1 23 6 23 1 24 7 24 1 25 9 25 1 26 9 26 1 27 11 27 1 28 13 28 1 29 14 29 1 30 16 30 1 31 16 31 1 32 17 32 1 33 17 33 1 34 17 34 1 35 18 35 1 36 18 36 1 37 18 37 1