@MOLECULE fludarabine 32 34 0 0 0 SMALL GASTEIGER @ATOM 1 F -1.8543 -2.8568 0.5796 F 1 UNL1111111111 -0.0849 2 O4* 1.6761 0.0223 -1.1904 O.3 1 UNL1111111111 -0.3733 3 O2* 1.3746 0.8972 1.9066 O.3 1 UNL1111111111 -0.5168 4 O3* 4.4172 0.8692 0.2178 O.3 1 UNL1111111111 -0.5452 5 O5* 1.4490 -2.6474 -1.1164 O.3 1 UNL1111111111 -0.5166 6 N -0.0160 1.3819 -0.3991 N.ar 1 UNL1111111111 -0.3488 7 N -2.0568 2.4025 -0.4471 N.ar 1 UNL1111111111 -0.3145 8 N -0.7837 -0.9216 0.1541 N.ar 1 UNL1111111111 -0.5622 9 N -3.2265 -1.0952 0.2802 N.ar 1 UNL1111111111 -0.5681 10 N -4.6449 0.7389 0.0085 N.pl3 1 UNL1111111111 -0.5272 11 C2* 2.1857 1.2296 0.8269 C.3 1 UNL1111111111 0.0788 12 C1* 1.4288 1.2470 -0.5368 C.3 1 UNL1111111111 0.2238 13 C3* 3.2706 0.1479 0.6071 C.3 1 UNL1111111111 0.0432 14 C4* 2.7407 -0.7008 -0.5604 C.3 1 UNL1111111111 0.0045 15 C5* 2.1959 -2.0583 -0.0833 C.3 1 UNL1111111111 -0.0303 16 C -0.9482 0.4001 -0.1312 C.ar 1 UNL1111111111 0.3210 17 C -0.7511 2.5944 -0.5811 C.ar 1 UNL1111111111 0.1313 18 C -2.2325 1.0489 -0.1796 C.ar 1 UNL1111111111 -0.2247 19 C -3.3843 0.2459 0.0350 C.ar 1 UNL1111111111 0.4859 20 C -1.9576 -1.5711 0.3262 C.ar 1 UNL1111111111 0.5433 21 H2* 2.6120 2.2193 1.1009 H 1 UNL1111111111 0.1795 22 H1* 1.8051 2.0515 -1.2218 H 1 UNL1111111111 0.1604 23 H3* 3.4808 -0.4227 1.5330 H 1 UNL1111111111 0.1493 24 H4* 3.4797 -0.8247 -1.3822 H 1 UNL1111111111 0.1638 25 H5*1 1.5661 -1.9608 0.8211 H 1 UNL1111111111 0.1324 26 H5*2 3.0158 -2.7766 0.1027 H 1 UNL1111111111 0.1389 27 H2* 0.8660 0.0675 1.7355 H 1 UNL1111111111 0.3367 28 H3* 5.2004 0.2850 0.1695 H 1 UNL1111111111 0.3237 29 H -0.2594 3.5319 -0.7891 H 1 UNL1111111111 0.1994 30 H5* 0.5864 -2.1661 -1.1803 H 1 UNL1111111111 0.3392 31 H -4.7942 1.7166 -0.1610 H 1 UNL1111111111 0.3305 32 H -5.4338 0.1378 0.1501 H 1 UNL1111111111 0.3270 @BOND 1 1 20 1 2 2 12 1 3 2 14 1 4 3 11 1 5 3 27 1 6 4 13 1 7 4 28 1 8 5 15 1 9 5 30 1 10 6 12 1 11 6 16 ar 12 6 17 ar 13 7 17 ar 14 7 18 ar 15 8 16 ar 16 8 20 ar 17 9 19 ar 18 9 20 ar 19 10 19 1 20 10 31 1 21 10 32 1 22 11 12 1 23 11 13 1 24 11 21 1 25 12 22 1 26 13 14 1 27 13 23 1 28 14 15 1 29 14 24 1 30 15 25 1 31 15 26 1 32 16 18 ar 33 17 29 1 34 18 19 ar