0 mol 4 unq 0 iso 0 dist 8.24634 6.29581 7.35416 10.9872 7.91149 7.15474 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 9.16617 6.29581 6.42755 10.9872 5.39676 7.15474 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 5.96346 10.7734 7.98326 6.84216 6.76736 9.81983 numMergedOcc 0
3 mol 15 unq 0 iso 0 dist 5.89412 9.75966 6.03257 14.362 11.6414 6.31608 numMergedOcc 0
4 mol 15 unq 1 iso 0 dist 7.07399 4.39605 6.03257 9.91086 11.6414 6.31608 numMergedOcc 0
5 mol 17 unq 0 iso 0 dist 9.78331 4.03817 7.92012 8.70792 6.43075 5.16502 numMergedOcc 0
6 mol 17 unq 1 iso 0 dist 9.78331 4.03817 7.92012 9.79861 11.3153 8.26398 numMergedOcc 0
7 mol 24 unq 0 iso 0 dist 9.41441 12.2662 5.95834 12.6643 4.11146 5.9372 numMergedOcc 0
8 mol 24 unq 1 iso 0 dist 9.41441 12.2662 5.95834 17.1861 7.83331 8.17583 numMergedOcc 0
9 mol 24 unq 2 iso 0 dist 9.41441 8.67951 4.2121 12.0986 6.22954 7.03544 numMergedOcc 0
10 mol 24 unq 3 iso 0 dist 9.41441 8.67951 4.2121 12.6643 4.11146 6.93597 numMergedOcc 0
11 mol 24 unq 4 iso 0 dist 9.41441 8.52463 6.72323 16.3188 12.2839 7.85986 numMergedOcc 0
12 mol 24 unq 5 iso 0 dist 9.41441 8.52463 6.72323 12.0986 6.22954 4.30252 numMergedOcc 0
13 mol 24 unq 6 iso 0 dist 6.73939 6.56748 5.95834 9.52201 4.11146 5.9372 numMergedOcc 0
14 mol 24 unq 7 iso 0 dist 6.73939 6.56748 5.95834 10.794 7.83331 8.17583 numMergedOcc 0
15 mol 24 unq 8 iso 0 dist 6.73939 4.50066 4.2121 4.7841 6.22954 7.03544 numMergedOcc 0
16 mol 24 unq 9 iso 0 dist 6.73939 4.50066 4.2121 9.52201 4.11146 6.93597 numMergedOcc 0
17 mol 24 unq 10 iso 0 dist 6.73939 5.11617 6.72323 8.23075 12.2839 7.85986 numMergedOcc 0
18 mol 24 unq 11 iso 0 dist 6.73939 5.11617 6.72323 4.7841 6.22954 4.30252 numMergedOcc 0
19 mol 44 unq 0 iso 0 dist 9.6782 4.55437 7.48846 11.0768 8.06674 6.53981 numMergedOcc 0
20 mol 54 unq 0 iso 0 dist 6.14538 4.24786 9.17082 10.2546 10.1455 8.75957 numMergedOcc 0
21 mol 91 unq 0 iso 0 dist 5.73743 10.1024 8.66165 10.0233 5.21888 9.97813 numMergedOcc 0
22 mol 92 unq 0 iso 0 dist 5.9465 9.52327 5.50508 12.1221 9.18008 8.4219 numMergedOcc 0
23 mol 92 unq 1 iso 0 dist 6.97962 11.641 5.50508 15.3733 9.18008 8.4219 numMergedOcc 0
24 mol 92 unq 2 iso 0 dist 9.95342 7.34683 5.50508 12.7611 9.18008 8.4219 numMergedOcc 0
25 mol 102 unq 0 iso 0 dist 8.31932 4.48396 8.88394 5.54256 7.28191 6.07633 numMergedOcc 0
26 mol 113 unq 0 iso 0 dist 8.8822 7.27193 6.6317 7.02367 5.40648 9.62952 numMergedOcc 0
27 mol 119 unq 0 iso 0 dist 8.99399 7.45148 7.20249 7.60162 5.77063 6.21165 numMergedOcc 0
28 mol 129 unq 0 iso 0 dist 9.36851 4.55551 9.73158 12.0878 9.06432 8.98175 numMergedOcc 0
29 mol 129 unq 1 iso 0 dist 4.97175 4.55551 7.59327 12.0878 11.2951 8.98175 numMergedOcc 0
30 mol 141 unq 0 iso 0 dist 8.10291 14.7684 9.83945 10.8338 3.80087 9.59109 numMergedOcc 0
31 mol 141 unq 1 iso 0 dist 9.97343 9.74444 9.10042 17.2837 9.98068 9.59109 numMergedOcc 0
32 mol 141 unq 2 iso 0 dist 9.70413 10.3716 9.10042 14.7036 9.98068 9.59109 numMergedOcc 0
33 mol 232 unq 0 iso 0 dist 9.05071 4.9377 9.8664 8.25985 12.159 9.78273 numMergedOcc 0
34 mol 237 unq 0 iso 0 dist 9.16003 11.1554 8.10254 13.9287 5.18809 8.95332 numMergedOcc 0
35 mol 273 unq 0 iso 0 dist 8.49177 4.60101 7.16346 13.4127 9.84575 9.81919 numMergedOcc 0
36 mol 274 unq 0 iso 0 dist 9.85289 5.29529 6.88827 11.8311 8.87313 8.09181 numMergedOcc 0
37 mol 287 unq 0 iso 0 dist 6.89451 7.83813 6.95912 11.5975 5.9468 9.23152 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 6.89451 7.83813 6.95912 11.5975 5.9468 9.23152 numMergedOcc 0
39 mol 289 unq 0 iso 0 dist 6.89451 7.83813 6.95912 11.5975 5.9468 9.23152 numMergedOcc 0
