@MOLECULE FDBD00261 31 31 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.7219 -0.1308 0.5860 O.3 1 UNK -0.4859 2 N -3.9941 -0.5398 -1.0632 N.4 1 UNK 0.2230 3 C -3.0664 -0.3320 0.0475 C.3 1 UNK 0.0076 4 C1 -1.6363 -0.2880 -0.4921 C.3 1 UNK 0.1316 5 C2 0.6051 -0.0319 0.2602 C.ar 1 UNK 0.1266 6 C3 1.3845 -1.1821 0.1777 C.ar 1 UNK -0.0085 7 C4 1.1652 1.2184 0.0147 C.ar 1 UNK -0.0085 8 C5 -3.4287 0.9476 0.8017 C.3 1 UNK -0.0185 9 C6 2.7358 -1.0810 -0.1532 C.ar 1 UNK -0.0554 10 C7 2.5164 1.3194 -0.3166 C.ar 1 UNK -0.0554 11 C8 3.3018 0.1697 -0.4005 C.ar 1 UNK -0.0610 12 C9 0.7973 -2.5303 0.4380 C.3 1 UNK -0.0362 13 C10 0.3413 2.4609 0.0999 C.3 1 UNK -0.0362 14 H -3.7441 -1.3951 -1.5595 H 1 UNK 0.1998 15 H1 -3.9411 0.2526 -1.7033 H 1 UNK 0.1998 16 H2 -4.9444 -0.6218 -0.7017 H 1 UNK 0.1998 17 H3 -3.1378 -1.1431 0.7417 H 1 UNK 0.0881 18 H4 -1.4230 -1.2001 -1.0093 H 1 UNK 0.0754 19 H5 -1.5366 0.5381 -1.1647 H 1 UNK 0.0754 20 H6 -3.3679 1.7832 0.1362 H 1 UNK 0.0285 21 H7 -2.7465 1.0881 1.6140 H 1 UNK 0.0285 22 H8 -4.4253 0.8670 1.1828 H 1 UNK 0.0285 23 H9 3.3169 -1.9316 -0.2151 H 1 UNK 0.0621 24 H10 2.9350 2.2448 -0.4996 H 1 UNK 0.0621 25 H11 4.3015 0.2444 -0.6455 H 1 UNK 0.0618 26 H12 -0.2408 -2.4273 0.6761 H 1 UNK 0.0279 27 H13 1.3077 -2.9892 1.2589 H 1 UNK 0.0279 28 H14 0.9043 -3.1404 -0.4345 H 1 UNK 0.0279 29 H15 -0.6639 2.2050 0.3626 H 1 UNK 0.0279 30 H16 0.3468 2.9582 -0.8475 H 1 UNK 0.0279 31 H17 0.7506 3.1098 0.8457 H 1 UNK 0.0279 @BOND 1 1 4 1 2 1 5 1 3 2 3 1 4 3 4 1 5 3 8 1 6 5 6 ar 7 5 7 ar 8 6 9 ar 9 6 12 1 10 7 10 ar 11 7 13 1 12 9 11 ar 13 10 11 ar 14 2 14 1 15 2 15 1 16 2 16 1 17 3 17 1 18 4 18 1 19 4 19 1 20 8 20 1 21 8 21 1 22 8 22 1 23 9 23 1 24 10 24 1 25 11 25 1 26 12 26 1 27 12 27 1 28 12 28 1 29 13 29 1 30 13 30 1 31 13 31 1