@MOLECULE 6-(phosphonomethyl)decahydro-3-isoquinolinecarboxylic acid 38 39 0 0 0 SMALL GASTEIGER @ATOM 1 P 4.2434 0.3128 0.0079 P.3 1 UNL111111 0.2561 2 O 4.0442 0.8681 1.5027 O.3 1 UNL111111 -0.4079 3 O 5.0180 1.5078 -0.7412 O.3 1 UNL111111 -0.4217 4 O -5.3023 1.7717 0.8324 O.3 1 UNL111111 -0.5574 5 O 4.9595 -0.9641 -0.0475 O.2 1 UNL111111 -0.3597 6 OXT -5.3839 0.7503 -1.1505 O.2 1 UNL111111 -0.5017 7 N -3.7669 -1.2726 0.0703 N.3 1 UNL111111 -0.5235 8 C -1.1312 0.0513 0.2597 C.3 1 UNL111111 -0.0940 9 C -1.2733 -1.4060 -0.2241 C.3 1 UNL111111 -0.1620 10 C 0.1126 0.6905 -0.3734 C.3 1 UNL111111 -0.3066 11 C 1.3789 -0.1085 0.0124 C.3 1 UNL111111 -0.0538 12 C -0.0254 -2.2040 0.1694 C.3 1 UNL111111 -0.2804 13 C 1.2282 -1.5702 -0.4501 C.3 1 UNL111111 -0.2782 14 C -2.3893 0.8490 -0.1158 C.3 1 UNL111111 -0.3448 15 C -2.5410 -2.0252 0.4026 C.3 1 UNL111111 -0.1270 16 CA -3.6374 0.1457 0.4593 C.3 1 UNL111111 -0.0191 17 C 2.5819 0.6046 -0.6797 C.3 1 UNL111111 -0.1728 18 C -4.8581 0.8700 -0.0769 C.2 1 UNL111111 0.6226 19 H -1.0160 0.0561 1.3705 H 1 UNL111111 0.1412 20 H -1.3755 -1.4152 -1.3343 H 1 UNL111111 0.1412 21 H 0.0068 0.7290 -1.4725 H 1 UNL111111 0.1417 22 H 0.2083 1.7382 -0.0321 H 1 UNL111111 0.1407 23 H 1.4686 -0.0917 1.1279 H 1 UNL111111 0.1551 24 H -0.1200 -3.2537 -0.1645 H 1 UNL111111 0.1359 25 H 0.0772 -2.2461 1.2700 H 1 UNL111111 0.1410 26 H 2.1163 -2.1696 -0.1657 H 1 UNL111111 0.1589 27 H 1.1749 -1.6213 -1.5529 H 1 UNL111111 0.1384 28 H -2.4705 0.9411 -1.2155 H 1 UNL111111 0.1560 29 H -2.3215 1.8815 0.2744 H 1 UNL111111 0.1566 30 H -2.6809 -3.0727 0.0596 H 1 UNL111111 0.1454 31 H -2.4487 -2.0690 1.5099 H 1 UNL111111 0.1474 32 HA -3.6206 0.1897 1.5834 H 1 UNL111111 0.1821 33 H 2.4071 1.7265 -0.6528 H 1 UNL111111 0.1927 34 H 2.6063 0.3158 -1.7741 H 1 UNL111111 0.1865 35 H -3.9949 -1.3568 -0.9243 H 1 UNL111111 0.2711 36 H 4.8308 0.5945 2.0834 H 1 UNL111111 0.3199 37 H 6.0206 1.3653 -0.6814 H 1 UNL111111 0.3238 38 H -6.0995 2.2771 0.5360 H 1 UNL111111 0.3563 @BOND 1 1 2 1 2 1 3 1 3 1 5 2 4 1 17 1 5 2 36 1 6 3 37 1 7 4 18 1 8 4 38 1 9 6 18 2 10 7 15 1 11 7 16 1 12 7 35 1 13 8 9 1 14 8 10 1 15 8 14 1 16 8 19 1 17 9 12 1 18 9 15 1 19 9 20 1 20 10 11 1 21 10 21 1 22 10 22 1 23 11 13 1 24 11 17 1 25 11 23 1 26 12 13 1 27 12 24 1 28 12 25 1 29 13 26 1 30 13 27 1 31 14 16 1 32 14 28 1 33 14 29 1 34 15 30 1 35 15 31 1 36 16 18 1 37 16 32 1 38 17 33 1 39 17 34 1