0 mol 15 unq 0 iso 0 dist 9.62922 10.7239 8.4014 17.778 11.1793 9.29358 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 8.36742 4.52042 7.98005 10.7269 8.62111 6.73162 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 8.10028 4.52042 8.31381 10.7269 9.18438 6.73162 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 6.89423 10.0517 8.91596 11.3029 4.84198 8.68559 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 7.80117 9.69698 9.02471 16.4993 10.4465 9.83618 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 9.79386 5.90113 9.02471 14.2386 10.4465 9.83618 numMergedOcc 0
6 mol 45 unq 0 iso 0 dist 8.55903 8.60899 8.27463 7.62709 3.82801 9.20119 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 9.4238 5.13248 9.45682 9.25873 6.48911 8.40312 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 8.16392 11.8473 7.42146 11.7168 4.18875 7.20326 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 8.12319 5.26656 9.81269 6.16039 9.6361 6.79146 numMergedOcc 0
10 mol 130 unq 1 iso 0 dist 9.04366 14.0585 9.81269 17.3903 9.6361 6.79146 numMergedOcc 0
11 mol 131 unq 0 iso 0 dist 8.44004 5.29825 8.80895 10.1792 6.25029 6.91348 numMergedOcc 0
12 mol 131 unq 1 iso 0 dist 8.44004 5.29825 8.80895 13.4104 13.4297 9.51418 numMergedOcc 0
13 mol 175 unq 0 iso 0 dist 7.19751 9.72213 9.19156 18.4765 16.559 9.52634 numMergedOcc 0
14 mol 181 unq 0 iso 0 dist 7.39733 7.07865 8.29467 13.3613 9.55459 7.98142 numMergedOcc 0
15 mol 181 unq 1 iso 0 dist 7.39733 7.07865 8.29467 9.7281 7.66761 7.37327 numMergedOcc 0
16 mol 181 unq 2 iso 0 dist 8.74268 13.9526 8.29467 18.0564 9.55459 7.98142 numMergedOcc 0
17 mol 181 unq 3 iso 0 dist 8.74268 13.9526 8.29467 15.2712 7.66761 7.37327 numMergedOcc 0
18 mol 184 unq 0 iso 0 dist 7.72354 7.25468 9.84566 7.95111 4.11581 9.52936 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 7.26295 15.6354 9.52922 19.8693 13.3106 6.47873 numMergedOcc 0
20 mol 213 unq 0 iso 0 dist 8.64187 12.6417 8.82761 16.4821 14.229 6.0965 numMergedOcc 0
21 mol 213 unq 1 iso 0 dist 8.64187 12.6417 8.82761 15.0884 14.9475 9.59129 numMergedOcc 0
22 mol 238 unq 0 iso 0 dist 5.90826 6.13639 8.94231 6.19514 3.94343 6.05141 numMergedOcc 0
23 mol 238 unq 1 iso 0 dist 5.90826 5.59848 8.88652 12.5166 12.0336 8.14172 numMergedOcc 0
24 mol 238 unq 2 iso 0 dist 5.90826 5.59848 8.88652 6.19514 3.94343 8.09066 numMergedOcc 0
25 mol 238 unq 3 iso 0 dist 5.90826 7.17967 6.46771 12.5166 12.0336 6.77463 numMergedOcc 0
26 mol 238 unq 4 iso 0 dist 5.90826 7.17967 6.46771 6.19514 3.94343 7.2766 numMergedOcc 0
27 mol 238 unq 5 iso 0 dist 8.75412 11.8352 8.94231 10.9924 3.94343 6.05141 numMergedOcc 0
28 mol 238 unq 6 iso 0 dist 8.75412 7.31855 8.88652 11.8618 12.0336 8.14172 numMergedOcc 0
29 mol 238 unq 7 iso 0 dist 8.75412 7.31855 8.88652 10.9924 3.94343 8.09066 numMergedOcc 0
30 mol 238 unq 8 iso 0 dist 8.75412 5.91323 6.46771 11.8618 12.0336 6.77463 numMergedOcc 0
31 mol 238 unq 9 iso 0 dist 8.75412 5.91323 6.46771 10.9924 3.94343 7.2766 numMergedOcc 0
32 mol 256 unq 0 iso 0 dist 8.3597 9.94789 4.80903 10.3128 3.89364 5.24676 numMergedOcc 0
33 mol 257 unq 0 iso 0 dist 8.81508 6.64096 9.6834 7.48361 4.46167 7.14834 numMergedOcc 0
