0 mol 30 unq 0 iso 0 dist 9.48779 15.6743 8.7817 9.28546 8.58568 10.8374 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 9.48779 14.7063 7.55415 9.28546 8.58568 7.95173 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 5.82266 8.03687 8.7817 10.4378 8.58568 10.8374 numMergedOcc 0
3 mol 30 unq 3 iso 0 dist 5.82266 5.00923 7.55415 10.4378 8.58568 7.95173 numMergedOcc 0
4 mol 30 unq 4 iso 0 dist 5.26067 7.68563 8.7817 4.99274 8.58568 10.8374 numMergedOcc 0
5 mol 30 unq 5 iso 0 dist 5.26067 6.96216 7.55415 4.99274 8.58568 7.95173 numMergedOcc 0
6 mol 92 unq 0 iso 0 dist 9.14952 8.19473 8.65802 14.4819 9.20197 12.3813 numMergedOcc 0
7 mol 92 unq 1 iso 0 dist 8.24319 6.49891 8.65802 11.7017 9.20197 12.3813 numMergedOcc 0
8 mol 94 unq 0 iso 0 dist 7.04255 7.07376 8.16733 6.16159 5.18655 8.20144 numMergedOcc 0
9 mol 94 unq 1 iso 0 dist 7.04255 7.1623 9.97569 6.16159 5.18655 11.997 numMergedOcc 0
10 mol 94 unq 2 iso 0 dist 7.46708 4.44456 8.16733 9.59783 5.18655 8.20144 numMergedOcc 0
11 mol 94 unq 3 iso 0 dist 7.46708 8.92413 9.97569 9.59783 5.18655 11.997 numMergedOcc 0
12 mol 112 unq 0 iso 0 dist 9.71246 5.21064 6.43433 9.07168 7.82011 6.72991 numMergedOcc 0
13 mol 112 unq 1 iso 0 dist 9.71246 9.27307 9.92283 9.07168 7.82011 8.57646 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 8.07653 5.36168 9.28592 11.9421 6.82089 10.3933 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 8.07653 5.36168 9.28592 10.7817 5.38314 9.16988 numMergedOcc 0
16 mol 131 unq 0 iso 0 dist 7.29431 12.0685 9.15431 15.2824 9.39683 7.71288 numMergedOcc 0
17 mol 131 unq 1 iso 0 dist 7.29431 11.4089 6.92648 15.2824 9.39683 4.89973 numMergedOcc 0
18 mol 131 unq 2 iso 0 dist 7.29431 15.3289 9.29384 15.2824 9.39683 7.00551 numMergedOcc 0
19 mol 131 unq 3 iso 0 dist 5.5811 9.89836 9.15431 6.2367 9.39683 7.71288 numMergedOcc 0
20 mol 131 unq 4 iso 0 dist 5.5811 6.84632 6.92648 6.2367 9.39683 4.89973 numMergedOcc 0
21 mol 131 unq 5 iso 0 dist 5.5811 6.24204 9.29384 6.2367 9.39683 7.00551 numMergedOcc 0
22 mol 156 unq 0 iso 0 dist 7.61925 12.0888 9.43259 5.75165 6.87906 13.2847 numMergedOcc 0
23 mol 156 unq 1 iso 0 dist 7.61925 12.0888 9.43259 11.4442 8.49473 16.5051 numMergedOcc 0
24 mol 156 unq 2 iso 0 dist 7.61925 12.0888 9.43259 6.86887 7.94975 5.97294 numMergedOcc 0
25 mol 156 unq 3 iso 0 dist 7.61925 12.0888 9.43259 7.40101 9.39865 13.6496 numMergedOcc 0
26 mol 186 unq 0 iso 0 dist 9.12278 8.08069 6.72641 12.3833 9.59034 10.5203 numMergedOcc 0
27 mol 210 unq 0 iso 0 dist 9.47863 11.354 7.63018 4.4371 6.4829 10.9823 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 8.72988 8.83001 7.05523 10.7561 7.2498 7.62375 numMergedOcc 0
29 mol 214 unq 1 iso 0 dist 8.72988 6.96634 8.46327 10.7561 7.2498 10.7373 numMergedOcc 0
30 mol 230 unq 0 iso 0 dist 9.64399 16.0775 9.09271 9.56877 8.85215 11.2344 numMergedOcc 0
31 mol 230 unq 1 iso 0 dist 9.64399 15.033 7.44838 9.56877 8.85215 8.44099 numMergedOcc 0
32 mol 230 unq 2 iso 0 dist 5.74356 8.4421 9.09271 11.0481 8.85215 11.2344 numMergedOcc 0
33 mol 230 unq 3 iso 0 dist 5.74356 5.04708 7.44838 11.0481 8.85215 8.44099 numMergedOcc 0
34 mol 230 unq 4 iso 0 dist 5.13701 7.60811 9.09271 5.33166 8.85215 11.2344 numMergedOcc 0
35 mol 230 unq 5 iso 0 dist 5.13701 6.84232 7.44838 5.33166 8.85215 8.44099 numMergedOcc 0
36 mol 240 unq 0 iso 0 dist 8.28101 15.208 9.47583 11.2258 8.33853 10.7371 numMergedOcc 0
37 mol 240 unq 1 iso 0 dist 8.28101 15.208 9.47583 5.96112 5.66537 13.9225 numMergedOcc 0
38 mol 240 unq 2 iso 0 dist 8.28101 14.9401 8.44909 11.2258 8.33853 7.75407 numMergedOcc 0
39 mol 240 unq 3 iso 0 dist 8.28101 14.9401 8.44909 5.96112 5.66537 12.076 numMergedOcc 0
40 mol 272 unq 0 iso 0 dist 9.13006 14.5343 9.64269 14.0414 7.55161 4.72202 numMergedOcc 0
41 mol 272 unq 1 iso 0 dist 9.13006 10.3334 6.88809 14.0414 7.55161 8.5751 numMergedOcc 0
42 mol 272 unq 2 iso 0 dist 9.13006 7.59176 8.46061 14.0414 7.55161 8.52877 numMergedOcc 0
43 mol 272 unq 3 iso 0 dist 8.42563 10.4754 9.64269 5.85512 7.55161 4.72202 numMergedOcc 0
44 mol 272 unq 4 iso 0 dist 8.42563 12.8342 6.88809 5.85512 7.55161 8.5751 numMergedOcc 0
45 mol 272 unq 5 iso 0 dist 8.42563 12.6468 8.46061 5.85512 7.55161 8.52877 numMergedOcc 0
46 mol 277 unq 0 iso 0 dist 6.36266 7.43608 6.57903 4.90291 7.25677 9.92201 numMergedOcc 0
47 mol 277 unq 1 iso 0 dist 6.36266 6.22629 9.65707 4.90291 7.25677 7.29899 numMergedOcc 0
48 mol 277 unq 2 iso 0 dist 6.74915 5.03347 9.3936 4.90291 6.73126 6.21891 numMergedOcc 0
49 mol 279 unq 0 iso 0 dist 5.26264 9.82157 8.29305 7.6493 8.23056 5.3373 numMergedOcc 0
50 mol 279 unq 1 iso 0 dist 5.26264 5.17146 6.43341 7.6493 8.23056 7.18967 numMergedOcc 0
51 mol 282 unq 0 iso 0 dist 5.69383 4.85878 5.23193 11.6778 9.96468 7.30164 numMergedOcc 0
52 mol 282 unq 1 iso 0 dist 5.69383 4.85878 5.23193 10.8027 9.59817 8.36249 numMergedOcc 0
