0 mol 7 unq 0 iso 0 dist 9.60499 6.02702 8.43473 11.8172 11.0773 8.72114 10.2465 13.6105 5.5683 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.60499 6.7985 6.55304 9.0379 10.6581 9.68596 10.25 15.7311 10.1841 9.87885 numMergedOcc 0
2 mol 8 unq 0 iso 0 dist 8.96553 8.53529 4.36226 12.4076 10.9634 7.03958 12.536 7.12261 4.1204 6.56356 numMergedOcc 0
3 mol 8 unq 1 iso 0 dist 8.96553 8.53529 4.36226 8.4069 9.62879 7.18019 12.536 7.12261 4.1204 9.01112 numMergedOcc 0
4 mol 8 unq 2 iso 0 dist 8.96553 8.53529 4.36226 12.9016 12.4058 8.44009 12.536 7.12261 4.1204 7.62333 numMergedOcc 0
5 mol 8 unq 3 iso 0 dist 9.62879 7.18019 4.36226 10.9495 10.9634 7.03958 9.01112 7.12261 4.1204 6.56356 numMergedOcc 0
6 mol 8 unq 4 iso 0 dist 9.62879 7.18019 4.36226 6.23795 12.4058 8.44009 9.01112 7.12261 4.1204 7.62333 numMergedOcc 0
7 mol 15 unq 0 iso 0 dist 8.38064 7.48342 4.39605 11.7498 10.6338 6.42748 9.84471 5.49251 5.20798 8.85174 numMergedOcc 0
8 mol 15 unq 1 iso 0 dist 9.97507 7.48342 12.1303 11.7498 18.3783 6.42748 9.84471 13.7602 5.20798 8.85174 numMergedOcc 0
9 mol 24 unq 0 iso 0 dist 6.86014 7.29868 8.52463 10.0952 8.86116 8.60554 16.0162 11.6226 15.4445 8.09311 numMergedOcc 0
10 mol 24 unq 1 iso 0 dist 6.86014 7.29868 8.52463 10.0952 8.86116 8.60554 16.8554 13.1949 11.8971 9.05357 numMergedOcc 0
11 mol 24 unq 2 iso 0 dist 6.86014 9.41441 6.66749 11.4989 11.0194 6.73939 17.6792 17.5858 12.5545 6.6219 numMergedOcc 0
12 mol 24 unq 3 iso 0 dist 6.86014 9.41441 6.66749 11.4989 11.0194 6.73939 12.5088 8.91183 4.08755 5.68215 numMergedOcc 0
13 mol 24 unq 4 iso 0 dist 8.86116 9.41441 14.012 11.4989 13.2433 6.73939 17.6792 18.6847 12.5545 6.6219 numMergedOcc 0
14 mol 24 unq 5 iso 0 dist 8.86116 9.41441 14.012 11.4989 13.2433 6.73939 12.5088 14.8647 4.08755 5.68215 numMergedOcc 0
15 mol 24 unq 6 iso 0 dist 5.54419 8.4051 5.11617 14.6259 13.2433 8.60554 20.3516 19.1966 15.4445 8.09311 numMergedOcc 0
16 mol 24 unq 7 iso 0 dist 5.54419 8.4051 5.11617 14.6259 13.2433 8.60554 12.5061 13.7225 11.8971 9.05357 numMergedOcc 0
17 mol 24 unq 8 iso 0 dist 5.54419 8.75662 10.8238 14.6259 13.2433 9.44691 20.3516 19.1966 13.0295 8.09311 numMergedOcc 0
18 mol 24 unq 9 iso 0 dist 5.54419 8.75662 10.8238 14.6259 13.2433 9.44691 12.5061 13.7225 4.02219 9.05357 numMergedOcc 0
19 mol 24 unq 10 iso 0 dist 5.54419 8.70827 5.59311 12.3067 7.36323 9.12854 10.4135 6.28159 9.86385 8.87744 numMergedOcc 0
20 mol 24 unq 11 iso 0 dist 5.54419 8.70827 5.59311 12.3067 7.36323 9.12854 9.33482 5.50396 10.4353 7.27472 numMergedOcc 0
21 mol 24 unq 12 iso 0 dist 5.54419 6.73939 12.176 11.4989 15.5324 9.41441 10.9113 13.6174 10.0453 7.95042 numMergedOcc 0
22 mol 24 unq 13 iso 0 dist 7.36323 8.4051 13.2229 14.6259 15.5296 8.60554 20.3516 19.7049 15.4445 8.09311 numMergedOcc 0
23 mol 24 unq 14 iso 0 dist 7.36323 8.4051 13.2229 14.6259 15.5296 8.60554 12.5061 10.1331 11.8971 9.05357 numMergedOcc 0
24 mol 24 unq 15 iso 0 dist 7.36323 8.75662 6.7828 14.6259 15.5296 9.44691 20.3516 19.7049 13.0295 8.09311 numMergedOcc 0
25 mol 24 unq 16 iso 0 dist 7.36323 8.75662 6.7828 14.6259 15.5296 9.44691 12.5061 10.1331 4.02219 9.05357 numMergedOcc 0
26 mol 24 unq 17 iso 0 dist 7.36323 9.12854 5.59311 12.3067 5.54419 8.70827 11.0181 4.82629 4.04519 6.6219 numMergedOcc 0
27 mol 24 unq 18 iso 0 dist 7.36323 9.12854 5.59311 12.3067 5.54419 8.70827 17.003 10.1698 13.7009 5.68215 numMergedOcc 0
28 mol 25 unq 0 iso 0 dist 5.04899 7.45383 7.33728 10.9391 11.9561 6.16347 12.3944 11.6045 5.46578 4.79873 numMergedOcc 0
29 mol 25 unq 1 iso 0 dist 5.04899 7.45383 7.33728 10.9391 11.9561 6.16347 9.49421 13.6145 9.62058 9.48085 numMergedOcc 0
30 mol 25 unq 2 iso 0 dist 7.57578 6.16347 9.34396 10.9391 12.7009 7.45383 11.037 13.2447 4.98822 6.55597 numMergedOcc 0
31 mol 25 unq 3 iso 0 dist 7.57578 6.16347 9.34396 10.9391 12.7009 7.45383 16.4232 18.6183 11.0227 7.52933 numMergedOcc 0
32 mol 25 unq 4 iso 0 dist 7.57578 6.16347 9.34396 10.9391 12.7009 7.45383 14.581 11.3512 10.3547 9.71956 numMergedOcc 0
33 mol 25 unq 5 iso 0 dist 7.57578 6.16347 9.34396 10.9391 12.7009 7.45383 13.0315 11.8139 7.91914 7.07751 numMergedOcc 0
34 mol 25 unq 6 iso 0 dist 7.57578 6.16347 9.34396 10.9391 12.7009 7.45383 17.2964 17.5134 11.7069 8.23761 numMergedOcc 0
35 mol 25 unq 7 iso 0 dist 7.57578 6.16347 9.34396 10.9391 12.7009 7.45383 9.48085 5.18617 9.62058 9.49421 numMergedOcc 0
36 mol 25 unq 8 iso 0 dist 7.57578 7.92503 6.11127 10.6808 13.7311 8.6653 16.617 16.6583 10.8122 7.6114 numMergedOcc 0
37 mol 25 unq 9 iso 0 dist 7.57578 8.50222 6.08585 15.5644 11.9561 8.87757 10.9703 5.63212 3.904 7.05196 numMergedOcc 0
38 mol 25 unq 10 iso 0 dist 7.17969 6.16347 10.8498 10.9391 12.8117 7.45383 11.037 14.9982 4.98822 6.55597 numMergedOcc 0
39 mol 25 unq 11 iso 0 dist 7.17969 6.16347 10.8498 10.9391 12.8117 7.45383 16.4232 19.7151 11.0227 7.52933 numMergedOcc 0
40 mol 25 unq 12 iso 0 dist 7.17969 6.16347 10.8498 10.9391 12.8117 7.45383 14.581 14.0853 10.3547 9.71956 numMergedOcc 0
41 mol 25 unq 13 iso 0 dist 7.17969 6.16347 10.8498 10.9391 12.8117 7.45383 13.0315 14.1251 7.91914 7.07751 numMergedOcc 0
42 mol 25 unq 14 iso 0 dist 7.17969 6.16347 10.8498 10.9391 12.8117 7.45383 17.2964 19.2117 11.7069 8.23761 numMergedOcc 0
43 mol 25 unq 15 iso 0 dist 7.17969 6.16347 10.8498 10.9391 12.8117 7.45383 9.48085 5.68041 9.62058 9.49421 numMergedOcc 0
44 mol 25 unq 16 iso 0 dist 7.17969 7.92503 5.30154 10.6808 12.9968 8.6653 16.617 15.8087 10.8122 7.6114 numMergedOcc 0
45 mol 25 unq 17 iso 0 dist 7.17969 7.55264 6.08585 16.1048 11.9561 8.87757 10.3338 5.63212 3.904 7.05196 numMergedOcc 0
46 mol 25 unq 18 iso 0 dist 7.31767 8.6653 5.64303 10.6808 12.4135 7.92503 11.4732 14.1577 11.0175 4.79873 numMergedOcc 0
47 mol 25 unq 19 iso 0 dist 7.31767 8.6653 5.64303 10.6808 12.4135 7.92503 17.8732 15.57 10.2758 9.48085 numMergedOcc 0
48 mol 25 unq 20 iso 0 dist 6.03987 8.6653 5.82503 10.6808 11.6743 7.92503 11.4732 14.321 11.0175 4.79873 numMergedOcc 0
49 mol 25 unq 21 iso 0 dist 6.03987 8.6653 5.82503 10.6808 11.6743 7.92503 17.8732 15.7846 10.2758 9.48085 numMergedOcc 0
50 mol 58 unq 0 iso 0 dist 6.86465 9.92355 5.78774 5.30792 6.62496 5.93884 13.3281 9.87158 5.66912 9.22598 numMergedOcc 0
51 mol 58 unq 1 iso 0 dist 6.86465 9.92355 5.78774 5.35073 6.35756 7.68678 13.3281 9.87158 5.66912 8.96727 numMergedOcc 0
52 mol 58 unq 2 iso 0 dist 6.86465 9.92355 5.78774 5.35073 6.35756 7.68678 11.5155 5.86526 5.76523 8.01308 numMergedOcc 0
53 mol 58 unq 3 iso 0 dist 6.62496 5.93884 5.78774 4.81926 6.35756 7.68678 9.22598 9.87158 5.66912 8.96727 numMergedOcc 0
54 mol 58 unq 4 iso 0 dist 6.62496 5.93884 5.78774 4.81926 6.35756 7.68678 9.55996 5.86526 5.76523 8.01308 numMergedOcc 0
55 mol 58 unq 5 iso 0 dist 6.35756 7.68678 5.78774 4.81926 6.62496 5.93884 8.96727 9.87158 5.66912 9.22598 numMergedOcc 0
56 mol 85 unq 0 iso 0 dist 5.73196 9.39864 4.65335 10.1164 7.66905 7.54568 11.2056 5.59906 4.93735 7.7068 numMergedOcc 0
57 mol 98 unq 0 iso 0 dist 5.08437 6.7117 7.06961 8.40073 6.10456 4.47349 9.81956 10.4782 3.92737 7.54889 numMergedOcc 0
58 mol 98 unq 1 iso 0 dist 5.08437 6.7117 7.06961 8.40073 6.10456 4.47349 5.10496 3.9764 3.94967 5.2571 numMergedOcc 0
59 mol 98 unq 2 iso 0 dist 5.08437 6.7117 7.06961 10.2427 10.1136 5.65185 9.81956 10.4782 3.92737 7.78931 numMergedOcc 0
60 mol 98 unq 3 iso 0 dist 5.08437 6.7117 7.06961 10.2427 10.1136 5.65185 5.10496 3.9764 3.94967 8.7497 numMergedOcc 0
61 mol 98 unq 4 iso 0 dist 6.10456 4.47349 7.06961 8.40073 5.08437 6.7117 5.2571 3.9764 3.94967 5.10496 numMergedOcc 0
62 mol 98 unq 5 iso 0 dist 6.10456 4.47349 7.06961 5.02887 10.1136 5.65185 7.54889 10.4782 3.92737 7.78931 numMergedOcc 0
63 mol 98 unq 6 iso 0 dist 6.10456 4.47349 7.06961 5.02887 10.1136 5.65185 5.2571 3.9764 3.94967 8.7497 numMergedOcc 0
64 mol 100 unq 0 iso 0 dist 7.17106 7.10378 10.6848 10.8586 10.1489 7.80975 15.6594 9.81953 15.0328 9.90751 numMergedOcc 0
65 mol 100 unq 1 iso 0 dist 7.17106 7.10378 10.6848 10.8586 10.1489 7.80975 10.5432 4.03277 12.48 9.21662 numMergedOcc 0
66 mol 119 unq 0 iso 0 dist 8.73993 6.52773 7.20179 4.85907 10.3704 9.11344 7.64052 9.68677 5.37917 6.99446 numMergedOcc 0
67 mol 119 unq 1 iso 0 dist 9.87172 9.11344 10.9441 4.85907 12.6489 6.52773 6.99446 6.20019 5.37917 7.64052 numMergedOcc 0
68 mol 130 unq 0 iso 0 dist 9.28393 7.96646 6.73735 10.7116 12.2375 7.90048 14.3291 10.6479 6.39648 9.98797 numMergedOcc 0
69 mol 133 unq 0 iso 0 dist 6.5107 6.66772 7.12976 7.6656 12.0352 7.71248 13.5471 14.5233 8.88402 8.26547 numMergedOcc 0
70 mol 133 unq 1 iso 0 dist 9.91388 9.97654 4.34568 6.761 7.24514 7.71248 12.4934 5.03174 8.88402 8.26547 numMergedOcc 0
71 mol 133 unq 2 iso 0 dist 9.52634 6.66772 4.34568 7.6656 7.24514 7.71248 13.5471 5.03174 8.88402 8.26547 numMergedOcc 0
72 mol 134 unq 0 iso 0 dist 9.89303 7.69991 4.60632 5.00526 9.93925 6.23142 11.2896 10.6898 6.93712 9.33094 numMergedOcc 0
73 mol 134 unq 1 iso 0 dist 9.89303 7.69991 4.60632 11.3271 14.423 9.94764 12.4385 15.5729 11.5269 9.1998 numMergedOcc 0
74 mol 134 unq 2 iso 0 dist 9.89303 7.69991 4.60632 11.3271 14.423 9.94764 11.2896 10.6898 6.93712 8.69531 numMergedOcc 0
75 mol 134 unq 3 iso 0 dist 6.54501 7.69991 5.71679 5.00526 6.49416 6.23142 11.2896 12.3479 6.93712 9.33094 numMergedOcc 0
76 mol 134 unq 4 iso 0 dist 6.54501 7.69991 5.71679 11.3271 12.5075 9.94764 12.4385 15.9138 11.5269 9.1998 numMergedOcc 0
77 mol 134 unq 5 iso 0 dist 6.54501 7.69991 5.71679 11.3271 12.5075 9.94764 11.2896 12.3479 6.93712 8.69531 numMergedOcc 0
78 mol 134 unq 6 iso 0 dist 8.94367 6.23142 4.57832 6.81259 9.86662 9.94764 11.0808 12.8086 11.5269 9.1998 numMergedOcc 0
79 mol 134 unq 7 iso 0 dist 8.94367 6.23142 4.57832 6.81259 9.86662 9.94764 9.33094 7.41373 6.93712 8.69531 numMergedOcc 0
80 mol 134 unq 8 iso 0 dist 6.37586 6.23142 5.29786 6.81259 9.71307 9.94764 11.0808 15.0225 11.5269 9.1998 numMergedOcc 0
81 mol 134 unq 9 iso 0 dist 6.37586 6.23142 5.29786 6.81259 9.71307 9.94764 9.33094 10.8635 6.93712 8.69531 numMergedOcc 0
82 mol 134 unq 10 iso 0 dist 6.49416 6.23142 5.71679 6.81259 12.5075 9.94764 11.0808 15.9138 11.5269 9.1998 numMergedOcc 0
83 mol 134 unq 11 iso 0 dist 6.49416 6.23142 5.71679 6.81259 12.5075 9.94764 9.33094 12.3479 6.93712 8.69531 numMergedOcc 0
84 mol 134 unq 12 iso 0 dist 9.86662 9.94764 4.57832 6.81259 8.94367 6.23142 8.69531 7.41373 6.93712 9.33094 numMergedOcc 0
85 mol 134 unq 13 iso 0 dist 9.71307 9.94764 5.29786 6.81259 6.37586 6.23142 8.69531 10.8635 6.93712 9.33094 numMergedOcc 0
86 mol 181 unq 0 iso 0 dist 9.1374 6.2479 6.6251 6.01247 9.94371 6.22122 9.76212 12.9532 6.39406 8.59874 numMergedOcc 0
87 mol 181 unq 1 iso 0 dist 8.03334 6.2479 7.81713 6.01247 10.9639 6.22122 9.76212 6.50233 6.39406 8.59874 numMergedOcc 0
88 mol 181 unq 2 iso 0 dist 5.98885 7.99195 6.6251 8.88798 9.1374 6.2479 13.2783 12.9532 6.39406 9.76212 numMergedOcc 0
89 mol 181 unq 3 iso 0 dist 5.98885 7.99195 6.6251 12.6324 9.94371 6.22122 13.2783 12.9532 6.39406 8.59874 numMergedOcc 0
90 mol 181 unq 4 iso 0 dist 9.09537 7.99195 10.09 8.88798 15.0228 6.2479 13.2783 12.7791 6.39406 9.76212 numMergedOcc 0
91 mol 181 unq 5 iso 0 dist 9.09537 7.99195 10.09 12.6324 16.2058 6.22122 13.2783 12.7791 6.39406 8.59874 numMergedOcc 0
92 mol 186 unq 0 iso 0 dist 7.54065 8.73217 11.7429 14.5862 16.3985 7.76163 10.8806 11.3979 3.78314 7.05695 numMergedOcc 0
93 mol 259 unq 0 iso 0 dist 8.13497 7.98231 8.41846 6.96053 10.3935 7.08526 10.3406 11.4598 4.47425 5.85442 numMergedOcc 0
94 mol 259 unq 1 iso 0 dist 8.13497 7.98231 8.41846 6.96053 10.3935 7.08526 9.46361 12.2293 4.10176 6.95511 numMergedOcc 0
95 mol 259 unq 2 iso 0 dist 7.88519 7.98231 8.81835 6.96053 7.46176 7.08526 10.3406 10.067 4.47425 5.85442 numMergedOcc 0
96 mol 259 unq 3 iso 0 dist 7.88519 7.98231 8.81835 6.96053 7.46176 7.08526 9.46361 11.6988 4.10176 6.95511 numMergedOcc 0
97 mol 259 unq 4 iso 0 dist 7.46176 7.08526 8.81835 6.96053 7.88519 7.98231 6.95511 11.6988 4.10176 9.46361 numMergedOcc 0
