@MOLECULE 4-cyanphenyl-ethyl-phenylphosphonat 34 35 0 0 0 SMALL GASTEIGER @ATOM 1 P -1.4248 -0.6801 0.5268 P.3 1 UNL1111111111111 0.2278 2 O -0.2099 -1.2211 -0.4294 O.3 1 UNL1111111111111 -0.3379 3 O -2.6164 -1.1234 -0.4388 O.3 1 UNL1111111111111 -0.2291 4 O -1.3582 -1.2565 1.8663 O.2 1 UNL1111111111111 -0.2900 5 N 6.3298 0.1766 -0.0975 N.1 1 UNL1111111111111 -0.2637 6 C -1.4939 1.0999 0.2739 C.ar 1 UNL1111111111111 0.0158 7 C -1.2334 1.9544 1.3611 C.ar 1 UNL1111111111111 -0.0558 8 C -1.7743 1.6367 -0.9969 C.ar 1 UNL1111111111111 -0.0574 9 C 1.0862 -0.8515 -0.2381 C.ar 1 UNL1111111111111 0.3324 10 C -2.9747 -2.5249 -0.5943 C.3 1 UNL1111111111111 0.0064 11 C -1.2419 3.3349 1.1611 C.ar 1 UNL1111111111111 -0.1827 12 C -1.7831 3.0202 -1.1696 C.ar 1 UNL1111111111111 -0.1891 13 C -1.5138 3.8665 -0.0968 C.ar 1 UNL1111111111111 -0.1023 14 C 1.9078 -1.5945 0.6250 C.ar 1 UNL1111111111111 -0.2460 15 C 1.6121 0.1575 -1.0634 C.ar 1 UNL1111111111111 -0.2679 16 C -4.4858 -2.4242 -0.7932 C.3 1 UNL1111111111111 -0.4694 17 C 3.2674 -1.3238 0.6533 C.ar 1 UNL1111111111111 -0.0602 18 C 2.9743 0.4145 -1.0244 C.ar 1 UNL1111111111111 -0.0591 19 C 3.8030 -0.3208 -0.1667 C.ar 1 UNL1111111111111 -0.1154 20 C 5.1939 -0.0476 -0.1282 C.1 1 UNL1111111111111 0.1272 21 H -1.0198 1.5829 2.3731 H 1 UNL1111111111111 0.1739 22 H -1.9909 1.0070 -1.8691 H 1 UNL1111111111111 0.1687 23 H -2.4531 -2.8780 -1.5079 H 1 UNL1111111111111 0.1306 24 H -2.7207 -3.1925 0.2519 H 1 UNL1111111111111 0.1412 25 H -1.0330 3.9994 1.9973 H 1 UNL1111111111111 0.1563 26 H -2.0009 3.4388 -2.1504 H 1 UNL1111111111111 0.1537 27 H -1.5169 4.9460 -0.2420 H 1 UNL1111111111111 0.1474 28 H 1.4787 -2.3708 1.2586 H 1 UNL1111111111111 0.1856 29 H 0.9580 0.7183 -1.7267 H 1 UNL1111111111111 0.1726 30 H -4.9948 -2.1503 0.1400 H 1 UNL1111111111111 0.1602 31 H -4.7390 -1.6542 -1.5344 H 1 UNL1111111111111 0.1578 32 H -4.8986 -3.3767 -1.1407 H 1 UNL1111111111111 0.1512 33 H 3.9244 -1.8899 1.3155 H 1 UNL1111111111111 0.1595 34 H 3.4032 1.1906 -1.6595 H 1 UNL1111111111111 0.1575 @BOND 1 1 2 1 2 1 3 1 3 1 4 2 4 1 6 1 5 2 9 1 6 3 10 1 7 5 20 3 8 6 7 ar 9 6 8 ar 10 7 11 ar 11 7 21 1 12 8 12 ar 13 8 22 1 14 9 14 ar 15 9 15 ar 16 10 16 1 17 10 23 1 18 10 24 1 19 11 13 ar 20 11 25 1 21 12 13 ar 22 12 26 1 23 13 27 1 24 14 17 ar 25 14 28 1 26 15 18 ar 27 15 29 1 28 16 30 1 29 16 31 1 30 16 32 1 31 17 19 ar 32 17 33 1 33 18 19 ar 34 18 34 1 35 19 20 1