@MOLECULE FDBD00186 35 36 0 0 0 SMALL GASTEIGER @ATOM 1 O 5.0298 1.5832 1.0057 O.3 1 UNK -0.3947 2 O1 4.4367 -1.4351 -1.7837 O.3 1 UNK -0.3947 3 O2 -4.5678 -1.0452 -0.4437 O.2 1 UNK -0.2650 4 N -0.2100 -0.8482 0.6788 N.ar 1 UNK -0.1244 5 N1 -1.2712 1.2598 0.1065 N.ar 1 UNK -0.1177 6 N2 -1.9778 -2.1762 0.3969 N.ar 1 UNK -0.2933 7 N3 -3.5917 1.0567 -0.4774 N.ar 1 UNK -0.2536 8 N4 -2.4863 3.1384 -0.4736 N.pl3 1 UNK -0.2897 9 C 3.5754 -0.1212 0.0756 C.3 1 UNK 0.0111 10 C1 2.0959 -0.4598 -0.2284 C.3 1 UNK 0.0142 11 C2 1.1579 -0.4454 0.9847 C.3 1 UNK 0.1587 12 C3 3.6688 1.2593 0.7491 C.3 1 UNK 0.0493 13 C4 4.4660 -0.1519 -1.1745 C.3 1 UNK 0.0493 14 C5 -1.2301 -0.0608 0.3010 C.ar 1 UNK 0.4801 15 C6 -2.3093 -0.8778 0.1297 C.ar 1 UNK 0.2529 16 C7 -0.6981 -2.1244 0.7266 C.ar 1 UNK 0.2513 17 C8 -3.5861 -0.3302 -0.2831 C.ar 1 UNK 0.2913 18 C9 -2.5021 1.7789 -0.2902 C.ar 1 UNK 0.3555 19 H 5.0805 2.4540 1.4299 H 1 UNK 0.2094 20 H1 5.0048 -1.4328 -2.5700 H 1 UNK 0.2094 21 H2 -0.4803 1.8316 0.2355 H 1 UNK 0.4627 22 H3 -2.5592 -2.9695 0.3538 H 1 UNK 0.1714 23 H4 -4.4236 1.5016 -0.7588 H 1 UNK 0.1760 24 H5 -1.6557 3.6455 -0.3249 H 1 UNK 0.1493 25 H6 -3.3056 3.6068 -0.7539 H 1 UNK 0.1493 26 H7 3.9386 -0.8804 0.7364 H 1 UNK 0.0347 27 H8 2.0627 -1.4382 -0.6604 H 1 UNK 0.0331 28 H9 1.7446 0.3100 -0.8833 H 1 UNK 0.0331 29 H10 1.5496 -1.1153 1.7214 H 1 UNK 0.1033 30 H11 1.1137 0.5660 1.3312 H 1 UNK 0.1033 31 H12 3.2442 1.9986 0.1026 H 1 UNK 0.0560 32 H13 3.1323 1.2361 1.6746 H 1 UNK 0.0560 33 H14 4.1135 0.5767 -1.8743 H 1 UNK 0.0560 34 H15 5.4723 0.0669 -0.8840 H 1 UNK 0.0560 35 H16 -0.1352 -2.9487 0.9886 H 1 UNK 0.1600 @BOND 1 1 12 1 2 2 13 1 3 3 17 2 4 4 11 1 5 4 14 ar 6 4 16 ar 7 5 14 ar 8 5 18 ar 9 6 15 ar 10 6 16 ar 11 7 17 ar 12 7 18 ar 13 8 18 1 14 9 10 1 15 9 12 1 16 9 13 1 17 10 11 1 18 14 15 ar 19 15 17 ar 20 1 19 1 21 2 20 1 22 5 21 1 23 6 22 1 24 7 23 1 25 8 24 1 26 8 25 1 27 9 26 1 28 10 27 1 29 10 28 1 30 11 29 1 31 11 30 1 32 12 31 1 33 12 32 1 34 13 33 1 35 13 34 1 36 16 35 1