@MOLECULE DB04551 34 34 1 SMALL USER_CHARGES @ATOM 1 P1 -2.2411 -2.6612 3.1603 P 1 noname 0.0156 2 O1 -1.7710 -3.5604 4.1821 O.2 1 noname -0.1965 3 O2 -1.1551 -1.6109 2.8616 O.3 1 noname -0.1505 4 O3 -2.5516 -3.4572 1.8791 O.3 1 noname -0.1644 5 O4 -3.5192 -1.9537 3.6475 O.3 1 noname -0.1644 6 C1 -1.6186 -0.7242 1.8540 C.3 1 noname 0.1191 7 C2 -0.5377 0.3212 1.5567 C.3 1 noname 0.2201 8 O5 0.6598 -0.3156 1.1020 O.3 1 noname -0.3370 9 O6 -0.3807 1.1215 2.7338 O.3 1 noname -0.3615 10 C3 -0.9004 1.2059 0.3589 C.3 1 noname 0.1386 11 C4 1.4278 0.7411 0.5141 C.3 1 noname 0.1141 12 O7 -1.6415 2.3306 0.8085 O.3 1 noname -0.3845 13 C5 0.4451 1.6717 -0.1982 C.3 1 noname 0.1139 14 C6 2.1567 1.5150 1.6145 C.3 1 noname 0.0915 15 O8 0.4891 1.4261 -1.5961 O.3 1 noname -0.3873 16 O9 3.0219 0.6358 2.3179 O.3 1 noname -0.1525 17 P2 3.7555 1.4147 3.4255 P 1 noname 0.0149 18 O10 4.6329 0.5231 4.1388 O.2 1 noname -0.1967 19 O11 2.7250 2.0111 4.4023 O.3 1 noname -0.1645 20 O12 4.5811 2.5507 2.7935 O.3 1 noname -0.1645 21 H1 -2.5059 -4.3974 2.0676 H 1 noname 0.2283 22 H2 -3.5343 -1.9453 4.6074 H 1 noname 0.2283 23 H3 -1.7484 -1.3392 0.9635 H 1 noname 0.0635 24 H4 -2.4748 -0.2104 2.2911 H 1 noname 0.0635 25 H5 -0.2788 0.5498 3.4982 H 1 noname 0.2137 26 H6 -1.5513 0.7307 -0.3749 H 1 noname 0.0687 27 H7 2.1445 0.2871 -0.1702 H 1 noname 0.0657 28 H8 -1.6508 2.3448 1.7684 H 1 noname 0.2108 29 H9 0.6521 2.7386 -0.1147 H 1 noname 0.0658 30 H10 2.8098 2.2458 1.1375 H 1 noname 0.0605 31 H11 1.4164 1.8407 2.3453 H 1 noname 0.0605 32 H12 0.4941 0.4793 -1.7546 H 1 noname 0.2106 33 H13 3.0078 1.8475 5.3050 H 1 noname 0.2283 34 H14 4.9711 3.0872 3.4876 H 1 noname 0.2283 @BOND 1 1 2 2 2 1 3 1 3 1 4 1 4 1 5 1 5 3 6 1 6 6 7 1 7 7 8 1 8 7 9 1 9 7 10 1 10 8 11 1 11 10 12 1 12 10 13 1 13 11 14 1 14 11 13 1 15 13 15 1 16 14 16 1 17 16 17 1 18 17 18 2 19 17 19 1 20 17 20 1 21 4 21 1 22 5 22 1 23 6 23 1 24 6 24 1 25 9 25 1 26 10 26 1 27 11 27 1 28 12 28 1 29 13 29 1 30 14 30 1 31 14 31 1 32 15 32 1 33 19 33 1 34 20 34 1 @SUBSTRUCTURE 1 noname 1