0 mol 7 unq 0 iso 0 dist 6.22892 15.5737 9.68596 14.422 9.0379 6.7985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.83658 4.91115 6.02702 13.5317 11.8172 8.72114 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 6.22805 13.6771 8.72114 16.6563 11.8172 6.02702 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 9.4523 14.5187 8.64915 15.9615 10.5747 7.32257 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 9.4523 14.5187 8.64915 10.2649 5.06358 6.55811 numMergedOcc 0
5 mol 9 unq 2 iso 0 dist 9.4523 10.6489 8.17347 10.2649 5.06358 7.36018 numMergedOcc 0
6 mol 16 unq 0 iso 0 dist 8.84153 12.7224 7.47858 16.5432 10.6922 6.62144 numMergedOcc 0
7 mol 19 unq 0 iso 0 dist 8.18518 10.5195 6.41575 12.9091 5.80928 6.41423 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 6.85331 12.8157 7.29868 21.1799 15.5315 8.4051 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 6.85331 12.8157 7.29868 10.4452 10.0952 8.60554 numMergedOcc 0
10 mol 24 unq 2 iso 0 dist 6.35095 8.7316 8.70827 12.4687 12.3067 9.12854 numMergedOcc 0
11 mol 24 unq 3 iso 0 dist 6.35095 10.9987 6.73939 17.6 11.4989 9.41441 numMergedOcc 0
12 mol 24 unq 4 iso 0 dist 5.87895 5.076 9.12854 11.0381 12.3067 8.70827 numMergedOcc 0
13 mol 25 unq 0 iso 0 dist 8.23292 14.4951 7.45383 17.4517 10.9391 6.16347 numMergedOcc 0
14 mol 30 unq 0 iso 0 dist 8.37503 7.07473 8.1284 9.91056 5.34368 7.12365 numMergedOcc 0
15 mol 98 unq 0 iso 0 dist 8.20865 9.83193 7.5242 14.7527 12.7411 5.78706 numMergedOcc 0
16 mol 98 unq 1 iso 0 dist 8.20865 9.83193 7.5242 15.0468 9.30161 7.23884 numMergedOcc 0
17 mol 98 unq 2 iso 0 dist 8.20865 9.83193 7.5242 9.49799 7.72877 5.59328 numMergedOcc 0
18 mol 130 unq 0 iso 0 dist 7.21902 9.37324 9.72053 16.9615 15.1532 7.7949 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 7.15203 5.86611 7.71248 12.6562 6.761 9.97654 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 7.15203 5.86611 7.71248 10.7939 7.6656 6.66772 numMergedOcc 0
21 mol 133 unq 2 iso 0 dist 9.89098 11.7971 9.97654 13.5771 6.69554 6.66772 numMergedOcc 0
22 mol 133 unq 3 iso 0 dist 9.89098 11.7971 9.97654 12.2343 6.761 7.71248 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 7.97208 15.4716 7.80532 11.8406 5.79898 5.83771 numMergedOcc 0
24 mol 155 unq 0 iso 0 dist 8.66709 12.1461 6.53347 15.5422 7.01918 8.69157 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 9.63295 5.39949 6.41453 13.3844 8.85576 9.39829 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 7.45401 6.0361 8.73217 12.2248 14.5862 7.76163 numMergedOcc 0
27 mol 206 unq 0 iso 0 dist 7.10166 14.2366 7.75885 11.1422 5.63422 6.16414 numMergedOcc 0
28 mol 206 unq 1 iso 0 dist 8.73396 11.3915 6.16414 11.7176 5.63422 7.75885 numMergedOcc 0
29 mol 206 unq 2 iso 0 dist 9.66896 5.91675 7.75885 10.4092 5.63422 6.16414 numMergedOcc 0
30 mol 238 unq 0 iso 0 dist 8.89538 16.6173 8.67864 15.5527 8.87326 8.94014 numMergedOcc 0
31 mol 238 unq 1 iso 0 dist 8.89538 16.6173 8.67864 13.8505 5.31152 7.02333 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 7.46199 7.71103 9.96262 11.9894 12.4198 9.63959 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 7.46199 7.71103 9.96262 13.0768 10.7374 7.21311 numMergedOcc 0
34 mol 259 unq 0 iso 0 dist 6.96379 7.39099 7.98231 11.1532 6.96053 7.08526 numMergedOcc 0
35 mol 271 unq 0 iso 0 dist 8.32351 6.38496 8.98576 12.4662 7.04094 8.92636 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 6.54753 7.10817 8.83865 10.3482 5.96724 9.18157 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 9.81087 13.6675 7.46394 20.1235 10.501 9.45514 numMergedOcc 0
38 mol 274 unq 1 iso 0 dist 9.81087 13.6675 7.46394 20.5454 14.3919 8.91672 numMergedOcc 0
39 mol 274 unq 2 iso 0 dist 9.81087 13.6675 7.46394 15.0228 6.15918 7.1729 numMergedOcc 0
40 mol 274 unq 3 iso 0 dist 9.79674 7.28382 8.91672 10.3113 14.3919 7.46394 numMergedOcc 0
41 mol 274 unq 4 iso 0 dist 9.79674 7.28382 8.91672 15.4388 11.7196 9.45514 numMergedOcc 0
42 mol 274 unq 5 iso 0 dist 9.79674 7.28382 8.91672 10.3376 10.0083 7.1729 numMergedOcc 0
43 mol 284 unq 0 iso 0 dist 7.2795 6.5455 9.33437 9.41428 5.87439 7.8343 numMergedOcc 0
44 mol 284 unq 1 iso 0 dist 9.41428 6.5455 7.8343 7.2795 5.87439 9.33437 numMergedOcc 0
45 mol 284 unq 2 iso 0 dist 7.35866 5.40432 9.33437 7.32482 5.87439 7.8343 numMergedOcc 0
46 mol 284 unq 3 iso 0 dist 7.32482 5.40432 7.8343 7.35866 5.87439 9.33437 numMergedOcc 0
47 mol 284 unq 4 iso 0 dist 8.08993 7.98227 7.8343 13.262 5.87439 9.33437 numMergedOcc 0
48 mol 287 unq 0 iso 0 dist 7.30618 8.32567 8.91712 13.4482 10.9208 9.65934 numMergedOcc 0
49 mol 287 unq 1 iso 0 dist 9.22306 7.04567 8.91712 15.7027 10.9208 9.65934 numMergedOcc 0
50 mol 288 unq 0 iso 0 dist 7.30618 8.32567 8.91712 13.4482 10.9208 9.65934 numMergedOcc 0
51 mol 288 unq 1 iso 0 dist 9.22306 7.04567 8.91712 15.7027 10.9208 9.65934 numMergedOcc 0
52 mol 289 unq 0 iso 0 dist 7.30618 8.32567 8.91712 13.4482 10.9208 9.65934 numMergedOcc 0
53 mol 289 unq 1 iso 0 dist 9.22306 7.04567 8.91712 15.7027 10.9208 9.65934 numMergedOcc 0
