0 mol 9 unq 0 iso 0 dist 9.8978 10.4202 7.35972 11.8248 8.50424 7.32257 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.8978 10.4202 7.35972 13.9579 6.02809 6.55811 numMergedOcc 0
2 mol 9 unq 2 iso 0 dist 9.8978 10.4202 7.35972 14.5722 4.98827 8.64915 numMergedOcc 0
3 mol 9 unq 3 iso 0 dist 9.8978 15.4091 9.93542 13.9579 6.02809 7.36018 numMergedOcc 0
4 mol 9 unq 4 iso 0 dist 9.8978 15.4091 9.93542 14.5722 4.98827 8.17347 numMergedOcc 0
5 mol 9 unq 5 iso 0 dist 6.26276 6.29049 7.35972 10.068 8.50424 7.32257 numMergedOcc 0
6 mol 9 unq 6 iso 0 dist 6.26276 6.29049 7.35972 10.1307 6.02809 6.55811 numMergedOcc 0
7 mol 9 unq 7 iso 0 dist 6.26276 6.29049 7.35972 10.1367 4.98827 8.64915 numMergedOcc 0
8 mol 9 unq 8 iso 0 dist 6.26276 10.6101 9.93542 10.1307 6.02809 7.36018 numMergedOcc 0
9 mol 9 unq 9 iso 0 dist 6.26276 10.6101 9.93542 10.1367 4.98827 8.17347 numMergedOcc 0
10 mol 11 unq 0 iso 0 dist 7.95811 4.46394 7.46578 5.95165 9.62262 5.96346 numMergedOcc 0
11 mol 11 unq 1 iso 0 dist 9.52695 9.36527 7.98326 14.3284 10.9183 6.35398 numMergedOcc 0
12 mol 11 unq 2 iso 0 dist 9.78754 9.66474 7.98326 14.2512 10.7734 5.96346 numMergedOcc 0
13 mol 11 unq 3 iso 0 dist 8.40993 11.501 7.46578 16.0707 9.62262 5.96346 numMergedOcc 0
14 mol 11 unq 4 iso 0 dist 8.23032 4.24301 7.90478 5.7435 9.99434 6.35398 numMergedOcc 0
15 mol 11 unq 5 iso 0 dist 8.22997 11.7321 7.90478 16.4599 9.99434 6.35398 numMergedOcc 0
16 mol 15 unq 0 iso 0 dist 5.19544 8.80394 6.03257 13.2865 10.1154 6.42748 numMergedOcc 0
17 mol 15 unq 1 iso 0 dist 5.19544 8.80394 6.03257 8.72187 4.29582 7.48342 numMergedOcc 0
18 mol 26 unq 0 iso 0 dist 9.32718 4.03003 6.93197 10.4427 7.23703 6.46104 numMergedOcc 0
19 mol 26 unq 1 iso 0 dist 9.32718 4.03003 6.93197 9.94775 5.81765 7.36856 numMergedOcc 0
20 mol 44 unq 0 iso 0 dist 9.45566 4.83412 7.48846 9.44909 4.55437 9.6782 numMergedOcc 0
21 mol 65 unq 0 iso 0 dist 5.83149 6.59475 5.94206 8.76461 5.51708 6.72639 numMergedOcc 0
22 mol 65 unq 1 iso 0 dist 5.83149 6.59475 5.94206 11.2698 6.47381 6.76508 numMergedOcc 0
23 mol 91 unq 0 iso 0 dist 5.51406 10.4949 8.66165 12.9007 10.1024 5.73743 numMergedOcc 0
24 mol 92 unq 0 iso 0 dist 5.62309 4.1125 6.77241 8.4545 8.70803 5.9465 numMergedOcc 0
25 mol 92 unq 1 iso 0 dist 5.62309 4.1125 6.77241 7.01176 8.87994 6.97962 numMergedOcc 0
26 mol 92 unq 2 iso 0 dist 5.62309 4.1125 6.77241 11.7125 7.52639 9.95342 numMergedOcc 0
27 mol 92 unq 3 iso 0 dist 7.11127 9.3668 5.50508 11.3075 9.52327 5.9465 numMergedOcc 0
28 mol 92 unq 4 iso 0 dist 7.11127 9.3668 5.50508 15.2593 11.641 6.97962 numMergedOcc 0
29 mol 92 unq 5 iso 0 dist 7.11127 9.3668 5.50508 9.5359 7.34683 9.95342 numMergedOcc 0
30 mol 92 unq 6 iso 0 dist 6.37888 4.00884 5.50508 9.28057 9.52327 5.9465 numMergedOcc 0
31 mol 92 unq 7 iso 0 dist 6.37888 4.00884 5.50508 10.3713 11.641 6.97962 numMergedOcc 0
32 mol 92 unq 8 iso 0 dist 6.37888 4.00884 5.50508 12.5277 7.34683 9.95342 numMergedOcc 0
33 mol 92 unq 9 iso 0 dist 7.11438 4.1125 5.50508 8.4545 9.52327 5.9465 numMergedOcc 0
34 mol 92 unq 10 iso 0 dist 7.11438 4.1125 5.50508 7.01176 11.641 6.97962 numMergedOcc 0
35 mol 92 unq 11 iso 0 dist 7.11438 4.1125 5.50508 11.7125 7.34683 9.95342 numMergedOcc 0
36 mol 98 unq 0 iso 0 dist 5.94696 12.5752 6.88901 12.3884 7.06961 6.65501 numMergedOcc 0
37 mol 119 unq 0 iso 0 dist 8.4733 5.73999 7.20249 6.40546 7.45148 8.99399 numMergedOcc 0
38 mol 171 unq 0 iso 0 dist 6.21194 4.47323 5.25109 9.87873 4.78075 6.64834 numMergedOcc 0
39 mol 171 unq 1 iso 0 dist 6.21194 4.47323 5.25109 10.2921 7.9651 5.93786 numMergedOcc 0
40 mol 171 unq 2 iso 0 dist 6.21194 4.47323 5.25109 11.2403 12.6853 8.24693 numMergedOcc 0
41 mol 171 unq 3 iso 0 dist 6.21194 4.47323 5.25109 9.80706 5.90026 7.36698 numMergedOcc 0
42 mol 171 unq 4 iso 0 dist 6.21194 4.73373 8.21618 10.2921 7.9651 8.1344 numMergedOcc 0
43 mol 171 unq 5 iso 0 dist 6.21194 4.73373 8.21618 11.2403 12.6853 6.71356 numMergedOcc 0
44 mol 181 unq 0 iso 0 dist 6.95568 10.453 8.86197 11.5719 8.04639 6.2479 numMergedOcc 0
45 mol 181 unq 1 iso 0 dist 6.95568 10.453 8.86197 14.736 13.0409 6.22122 numMergedOcc 0
46 mol 181 unq 2 iso 0 dist 6.95568 10.453 8.86197 11.4517 5.77299 7.99195 numMergedOcc 0
47 mol 181 unq 3 iso 0 dist 9.07527 10.0344 7.22883 13.9813 12.7358 9.72611 numMergedOcc 0
48 mol 232 unq 0 iso 0 dist 9.41148 6.36084 9.78181 7.70279 6.2188 8.50102 numMergedOcc 0
49 mol 232 unq 1 iso 0 dist 9.41148 6.36084 9.78181 9.29752 12.5452 9.40808 numMergedOcc 0
50 mol 232 unq 2 iso 0 dist 7.83422 6.36084 9.8664 7.70279 12.3508 8.50102 numMergedOcc 0
51 mol 232 unq 3 iso 0 dist 7.83422 6.36084 9.8664 9.29752 8.80479 9.40808 numMergedOcc 0
52 mol 237 unq 0 iso 0 dist 8.42502 3.96327 8.10254 11.0518 11.1554 9.16003 numMergedOcc 0
53 mol 238 unq 0 iso 0 dist 7.26887 6.5335 5.92374 14.0632 8.1195 8.69104 numMergedOcc 0
54 mol 244 unq 0 iso 0 dist 5.79898 4.38246 6.22122 7.65388 5.17744 5.50492 numMergedOcc 0
55 mol 273 unq 0 iso 0 dist 6.38341 7.55971 7.16346 10.1523 4.60101 8.49177 numMergedOcc 0
56 mol 274 unq 0 iso 0 dist 9.11072 5.15747 6.88827 12.6706 6.20558 8.52587 numMergedOcc 0
57 mol 274 unq 1 iso 0 dist 9.11072 5.15747 6.88827 6.55855 6.16703 6.39866 numMergedOcc 0
58 mol 274 unq 2 iso 0 dist 6.83113 5.15747 9.16942 12.6706 16.3619 8.52587 numMergedOcc 0
59 mol 274 unq 3 iso 0 dist 6.83113 5.15747 9.16942 6.55855 5.64601 6.39866 numMergedOcc 0
60 mol 274 unq 4 iso 0 dist 9.44134 6.70266 7.75216 10.0379 11.1602 7.46394 numMergedOcc 0
61 mol 274 unq 5 iso 0 dist 9.44134 6.70266 7.75216 6.55855 6.52035 9.45514 numMergedOcc 0
62 mol 274 unq 6 iso 0 dist 9.44134 6.70266 7.75216 12.5213 5.58338 8.91672 numMergedOcc 0
63 mol 274 unq 7 iso 0 dist 9.44134 6.70266 7.75216 9.52894 5.71192 7.1729 numMergedOcc 0
64 mol 274 unq 8 iso 0 dist 9.02071 4.36131 6.88827 9.71801 6.20558 8.52587 numMergedOcc 0
65 mol 274 unq 9 iso 0 dist 9.02071 4.36131 6.88827 9.7198 6.16703 6.39866 numMergedOcc 0
