@MOLECULE FDBD02355 44 45 0 0 0 SMALL GASTEIGER @ATOM 1 C 3.9044 -0.5847 2.1627 C.3 1 UNK -0.0467 2 C1 3.3716 -0.0774 0.8193 C.3 1 UNK 0.0210 3 C2 3.5631 1.4312 0.6627 C.3 1 UNK -0.0467 4 N 3.8961 -0.8507 -0.3315 N.am 1 UNK -0.2907 5 C3 2.9524 -1.8170 -0.9109 C.3 1 UNK 0.0403 6 C4 1.7523 -1.1675 -1.5775 C.ar 1 UNK -0.0301 7 C5 1.8990 -0.2232 -2.6047 C.ar 1 UNK -0.0571 8 C6 0.7846 0.3208 -3.2472 C.ar 1 UNK -0.0615 9 C7 -0.4961 -0.0480 -2.8510 C.ar 1 UNK -0.0617 10 C8 -0.6625 -0.9604 -1.8122 C.ar 1 UNK -0.0615 11 C9 0.4527 -1.5238 -1.1863 C.ar 1 UNK -0.0571 12 C10 5.2789 -0.8358 -0.5808 C.2 1 UNK 0.2471 13 O 6.0671 -0.1645 0.0879 O.2 1 UNK -0.2700 14 C11 5.8952 -1.6623 -1.6575 C.ar 1 UNK 0.0374 15 C12 7.1003 -2.3239 -1.3812 C.ar 1 UNK -0.0467 16 C13 7.7454 -3.0827 -2.3691 C.ar 1 UNK -0.0495 17 C14 9.0725 -3.7266 -2.0952 C.3 1 UNK -0.0397 18 C15 7.1736 -3.1704 -3.6449 C.ar 1 UNK -0.0559 19 C16 5.9818 -2.5008 -3.9420 C.ar 1 UNK -0.0495 20 C17 5.3823 -2.5945 -5.3144 C.3 1 UNK -0.0397 21 C18 5.3764 -1.7163 -2.9528 C.ar 1 UNK -0.0467 22 H 3.7511 -1.6415 2.2311 H 1 UNK 0.0247 23 H1 3.3841 -0.0965 2.9601 H 1 UNK 0.0247 24 H2 4.9502 -0.3705 2.2354 H 1 UNK 0.0247 25 H3 2.3154 -0.2485 0.8214 H 1 UNK 0.0495 26 H4 4.6085 1.6591 0.6544 H 1 UNK 0.0247 27 H5 3.0943 1.9371 1.4808 H 1 UNK 0.0247 28 H6 3.1205 1.7534 -0.2567 H 1 UNK 0.0247 29 H7 2.6002 -2.4569 -0.1290 H 1 UNK 0.0514 30 H8 3.4803 -2.3558 -1.6698 H 1 UNK 0.0514 31 H9 2.8452 0.0741 -2.8900 H 1 UNK 0.0621 32 H10 0.9118 0.9969 -4.0165 H 1 UNK 0.0618 33 H11 -1.3204 0.3530 -3.3251 H 1 UNK 0.0618 34 H12 -1.6121 -1.2212 -1.5037 H 1 UNK 0.0618 35 H13 0.3189 -2.2101 -0.4273 H 1 UNK 0.0621 36 H14 7.5175 -2.2517 -0.4401 H 1 UNK 0.0628 37 H15 9.3979 -4.2573 -2.9655 H 1 UNK 0.0278 38 H16 8.9757 -4.4090 -1.2768 H 1 UNK 0.0278 39 H17 9.7905 -2.9727 -1.8480 H 1 UNK 0.0278 40 H18 7.6368 -3.7353 -4.3738 H 1 UNK 0.0623 41 H19 4.4799 -2.0206 -5.3494 H 1 UNK 0.0278 42 H20 5.1633 -3.6175 -5.5389 H 1 UNK 0.0278 43 H21 6.0762 -2.2122 -6.0336 H 1 UNK 0.0278 44 H22 4.5328 -1.1690 -3.1848 H 1 UNK 0.0628 @BOND 1 6 7 ar 2 7 8 ar 3 6 11 ar 4 10 11 ar 5 9 10 ar 6 8 9 ar 7 14 21 ar 8 14 15 ar 9 19 21 ar 10 18 19 ar 11 16 18 ar 12 15 16 ar 13 1 2 1 14 2 4 1 15 4 12 am 16 12 14 1 17 19 20 1 18 16 17 1 19 12 13 2 20 4 5 1 21 5 6 1 22 2 3 1 23 1 22 1 24 1 23 1 25 1 24 1 26 2 25 1 27 3 26 1 28 3 27 1 29 3 28 1 30 5 29 1 31 5 30 1 32 7 31 1 33 8 32 1 34 9 33 1 35 10 34 1 36 11 35 1 37 15 36 1 38 17 37 1 39 17 38 1 40 17 39 1 41 18 40 1 42 20 41 1 43 20 42 1 44 20 43 1 45 21 44 1