@MOLECULE 57503665 30 32 1 SMALL USER_CHARGES @ATOM 1 Cl1 0.3043 1.1850 2.6575 Cl 1 noname -0.0767 2 Cl2 -2.0931 -2.3323 -2.9516 Cl 1 noname -0.0836 3 O1 1.4599 4.1087 0.6116 O.3 1 noname -0.3882 4 N1 1.6184 1.1756 0.4370 N.2 1 noname -0.2062 5 N2 1.7132 1.7237 -1.8494 N.2 1 noname -0.2056 6 C1 0.9324 -0.5006 -1.2042 C.2 1 noname 0.0218 7 C2 1.1473 -0.0803 0.1415 C.2 1 noname 0.0443 8 C3 1.2441 0.4792 -2.1923 C.2 1 noname 0.0532 9 C4 0.8732 -0.9632 1.1795 C.2 1 noname 0.0022 10 C5 0.0024 -1.4958 -1.4813 C.2 1 noname 0.0106 11 C6 1.9134 2.1080 -0.5381 C.2 1 noname 0.0743 12 C7 1.0406 0.1780 -3.5340 C.2 1 noname 0.0035 13 C8 0.4660 -0.4768 2.4163 C.2 1 noname 0.0122 14 C9 1.0065 -2.3324 0.9807 C.2 1 noname -0.0251 15 C10 -0.6238 -1.5360 -2.7216 C.2 1 noname -0.0024 16 C11 0.0609 -0.8505 -3.8150 C.2 1 noname -0.0069 17 C12 2.4132 3.4372 -0.1988 C.3 1 noname 0.1031 18 C13 0.1919 -1.3597 3.4543 C.2 1 noname -0.0207 19 C14 0.7324 -3.2153 2.0188 C.2 1 noname -0.0512 20 C15 0.3252 -2.7289 3.2556 C.2 1 noname -0.0430 21 H1 -0.2205 -2.1967 -0.7745 H 1 noname 0.0646 22 H2 1.5519 0.6538 -4.2774 H 1 noname 0.0646 23 H3 1.3053 -2.6893 0.0731 H 1 noname 0.0630 24 H4 -0.1524 -1.0976 -4.7814 H 1 noname 0.0638 25 H5 2.5789 4.0073 -1.1129 H 1 noname 0.0648 26 H6 3.3523 3.3439 0.3466 H 1 noname 0.0648 27 H7 -0.1069 -1.0028 4.3619 H 1 noname 0.0638 28 H8 0.8302 -4.2201 1.8729 H 1 noname 0.0622 29 H9 0.1241 -3.3768 4.0173 H 1 noname 0.0623 30 H10 1.7953 5.0009 0.8394 H 1 noname 0.2106 @BOND 1 1 13 1 2 2 15 1 3 3 17 1 4 3 30 1 5 4 7 2 6 4 11 1 7 5 8 1 8 5 11 2 9 6 7 1 10 6 8 2 11 6 10 1 12 7 9 1 13 8 12 1 14 9 13 1 15 9 14 2 16 10 15 2 17 10 21 1 18 11 17 1 19 12 16 2 20 12 22 1 21 13 18 2 22 14 19 1 23 14 23 1 24 15 16 1 25 16 24 1 26 17 25 1 27 17 26 1 28 18 20 1 29 18 27 1 30 19 20 2 31 19 28 1 32 20 29 1 @SUBSTRUCTURE 1 noname 1