@MOLECULE s-(acetamidomethyl)-n-[(9h-fluoren-9-ylmethoxy)carbonyl]-l-cysteine 51 53 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.4337 -0.4165 0.6289 S.3 1 UNK111111111 -0.0623 2 O 0.7875 1.6083 -0.9247 O.3 0 UNK0 -0.4096 3 O -0.8020 1.9984 -2.5325 O.2 0 UNK0 -0.5581 4 O -2.5226 3.0022 1.6442 O.3 1 UNK1 -0.5560 5 O -4.5491 3.1105 0.7190 O.2 1 UNK1 -0.4853 6 O -2.2777 -3.7117 -0.6772 O.2 1 UNK1 -0.5171 7 N -1.3394 1.8024 -0.3028 N.am 1 UNK1 -0.5962 8 N -1.7092 -2.4411 1.1102 N.am 1 UNK1 -0.5945 9 C 2.9027 0.6876 -1.4308 C.3 0 UNK0 -0.1598 10 C 3.4183 1.0645 -0.0571 C.ar 0 UNK0 -0.0005 11 C 2.4246 -0.7335 -1.2268 C.ar 0 UNK0 -0.0024 12 C 3.2744 -0.0306 0.8334 C.ar 0 UNK0 -0.0283 13 C 2.6622 -1.1414 0.1103 C.ar 0 UNK0 -0.0334 14 C 1.7983 1.6118 -1.9407 C.3 0 UNK0 -0.0012 15 C 3.9955 2.2447 0.3654 C.ar 0 UNK0 -0.1639 16 C 1.8572 -1.6007 -2.1386 C.ar 0 UNK0 -0.1642 17 C 3.7015 0.0624 2.1452 C.ar 0 UNK0 -0.1430 18 C 2.3309 -2.4168 0.5302 C.ar 0 UNK0 -0.1430 19 C 4.4243 2.3360 1.6972 C.ar 0 UNK0 -0.1383 20 C 1.5188 -2.8901 -1.7079 C.ar 0 UNK0 -0.1256 21 C 4.2811 1.2636 2.5723 C.ar 0 UNK0 -0.1531 22 C 1.7533 -3.2937 -0.3969 C.ar 0 UNK0 -0.1537 23 C -0.4816 1.8358 -1.3755 C.2 0 UNK0 0.7155 24 C -2.7626 2.0413 -0.5369 C.3 1 UNK1 0.0532 25 C -3.5315 0.7337 -0.7880 C.3 1 UNK1 -0.3480 26 C -3.4034 2.7599 0.6441 C.2 1 UNK1 0.6111 27 C -1.7729 -1.2227 0.3406 C.3 1 UNK1 -0.0923 28 C -1.9802 -3.6574 0.4960 C.2 1 UNK1 0.6105 29 C -1.8174 -4.8639 1.3767 C.3 1 UNK1 -0.5326 30 H 3.7476 0.7040 -2.1675 H 0 UNK0 0.1754 31 H 1.3861 1.2665 -2.9078 H 0 UNK0 0.1586 32 H 2.1404 2.6595 -2.0294 H 0 UNK0 0.1381 33 H 4.1200 3.0873 -0.3088 H 0 UNK0 0.1545 34 H 1.6743 -1.2981 -3.1663 H 0 UNK0 0.1589 35 H 3.5939 -0.7748 2.8288 H 0 UNK0 0.1537 36 H 2.5090 -2.7371 1.5551 H 0 UNK0 0.1515 37 H 4.8748 3.2626 2.0485 H 0 UNK0 0.1483 38 H 1.0618 -3.5860 -2.4125 H 0 UNK0 0.1563 39 H 4.6207 1.3533 3.6023 H 0 UNK0 0.1500 40 H 1.4835 -4.2998 -0.0852 H 0 UNK0 0.1480 41 H -2.8805 2.7115 -1.4486 H 1 UNK1 0.1964 42 H -0.9951 1.7695 0.6495 H 1 UNK1 0.3489 43 H -4.6100 0.9455 -0.9510 H 1 UNK1 0.1899 44 H -3.1776 0.2492 -1.7219 H 1 UNK1 0.1867 45 H -1.6566 -1.4329 -0.7487 H 1 UNK1 0.1839 46 H -0.9641 -0.5228 0.6474 H 1 UNK1 0.1588 47 H -1.5126 -2.3749 2.0945 H 1 UNK1 0.3151 48 H -2.9297 3.4429 2.4335 H 1 UNK1 0.3641 49 H -2.0057 -5.7784 0.7906 H 1 UNK1 0.1881 50 H -2.5263 -4.8623 2.2149 H 1 UNK1 0.1740 51 H -0.8023 -4.9455 1.7867 H 1 UNK1 0.1730 @BOND 1 1 25 1 2 1 27 1 3 2 14 1 4 2 23 1 5 3 23 2 6 4 26 1 7 4 48 1 8 5 26 2 9 6 28 2 10 7 23 am 11 7 24 1 12 7 42 1 13 8 27 1 14 8 28 am 15 8 47 1 16 9 10 1 17 9 11 1 18 9 14 1 19 9 30 1 20 10 12 ar 21 10 15 ar 22 11 13 ar 23 11 16 ar 24 12 13 1 25 12 17 ar 26 13 18 ar 27 14 31 1 28 14 32 1 29 15 19 ar 30 15 33 1 31 16 20 ar 32 16 34 1 33 17 21 ar 34 17 35 1 35 18 22 ar 36 18 36 1 37 19 21 ar 38 19 37 1 39 20 22 ar 40 20 38 1 41 21 39 1 42 22 40 1 43 24 25 1 44 24 26 1 45 24 41 1 46 25 43 1 47 25 44 1 48 27 45 1 49 27 46 1 50 28 29 1 51 29 49 1 52 29 50 1 53 29 51 1