0 mol 10 unq 0 iso 0 dist 5.40169 9.61828 5.59965 5.75317 7.8329 9.76721 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 4.90592 10.0715 6.72323 4.21283 7.85986 12.2839 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 4.90592 10.0715 6.72323 4.97191 4.30252 6.22954 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 9.36461 11.9395 6.72323 15.6099 7.85986 12.2839 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 9.36461 11.9395 6.72323 12.5557 4.30252 6.22954 numMergedOcc 0
5 mol 26 unq 0 iso 0 dist 9.5053 5.66783 6.56527 12.4814 9.11311 12.5394 numMergedOcc 0
6 mol 44 unq 0 iso 0 dist 7.03307 5.1728 7.48846 10.0772 6.53981 8.06674 numMergedOcc 0
7 mol 48 unq 0 iso 0 dist 7.59316 4.16161 8.29857 5.15398 6.28603 6.17529 numMergedOcc 0
8 mol 48 unq 1 iso 0 dist 7.59316 4.16161 8.29857 8.66294 8.80303 9.78584 numMergedOcc 0
9 mol 48 unq 2 iso 0 dist 7.59316 4.16161 8.29857 12.5266 7.11491 11.505 numMergedOcc 0
10 mol 48 unq 3 iso 0 dist 7.51285 4.20245 8.19993 5.15603 5.73454 6.30002 numMergedOcc 0
11 mol 48 unq 4 iso 0 dist 7.51285 4.20245 8.19993 8.37489 8.2012 9.72383 numMergedOcc 0
12 mol 48 unq 5 iso 0 dist 7.51285 4.20245 8.19993 12.6408 7.1829 11.5388 numMergedOcc 0
13 mol 48 unq 6 iso 0 dist 8.86698 14.2174 8.19993 8.08481 5.73454 6.30002 numMergedOcc 0
14 mol 48 unq 7 iso 0 dist 8.86698 14.2174 8.19993 5.87913 8.2012 9.72383 numMergedOcc 0
15 mol 48 unq 8 iso 0 dist 8.86698 14.2174 8.19993 9.01238 7.1829 11.5388 numMergedOcc 0
16 mol 79 unq 0 iso 0 dist 9.36156 6.01679 5.82754 11.6533 8.96069 6.07693 numMergedOcc 0
17 mol 79 unq 1 iso 0 dist 9.36156 11.0747 9.05679 11.6533 8.96069 5.25584 numMergedOcc 0
18 mol 85 unq 0 iso 0 dist 8.70863 8.31077 9.66222 14.1233 8.04853 11.3242 numMergedOcc 0
19 mol 85 unq 1 iso 0 dist 8.70863 8.31077 9.66222 14.3481 6.46549 15.4245 numMergedOcc 0
20 mol 92 unq 0 iso 0 dist 9.05259 8.0763 6.77241 15.041 6.89071 8.93569 numMergedOcc 0
21 mol 92 unq 1 iso 0 dist 9.05259 12.2082 5.50508 15.041 6.89071 3.98877 numMergedOcc 0
22 mol 119 unq 0 iso 0 dist 9.9151 4.99495 7.20249 8.90156 6.21165 5.77063 numMergedOcc 0
23 mol 129 unq 0 iso 0 dist 9.98397 5.51078 9.73158 7.42801 8.98175 9.06432 numMergedOcc 0
24 mol 129 unq 1 iso 0 dist 9.98397 6.80501 7.59327 7.42801 8.98175 11.2951 numMergedOcc 0
25 mol 129 unq 2 iso 0 dist 9.94578 6.84211 9.73158 11.1054 8.98175 9.06432 numMergedOcc 0
26 mol 129 unq 3 iso 0 dist 9.94578 4.53459 7.59327 11.1054 8.98175 11.2951 numMergedOcc 0
27 mol 131 unq 0 iso 0 dist 5.39061 5.67023 5.87084 4.9293 7.84546 4.60864 numMergedOcc 0
28 mol 131 unq 1 iso 0 dist 8.92828 11.6708 5.87084 16.0667 8.47526 4.94367 numMergedOcc 0
29 mol 131 unq 2 iso 0 dist 5.44303 5.66194 5.87084 9.93041 8.47526 4.94367 numMergedOcc 0
30 mol 141 unq 0 iso 0 dist 9.78667 8.69924 9.83945 11.2139 4.92382 13.8739 numMergedOcc 0
31 mol 141 unq 1 iso 0 dist 8.47026 9.33878 9.83945 10.7006 4.92382 13.8739 numMergedOcc 0
32 mol 141 unq 2 iso 0 dist 6.73983 8.69924 6.75376 13.2445 8.40695 5.59893 numMergedOcc 0
33 mol 141 unq 3 iso 0 dist 6.73983 8.69924 6.75376 11.2655 9.35867 3.89483 numMergedOcc 0
34 mol 141 unq 4 iso 0 dist 8.6387 9.33878 6.75376 14.0635 8.40695 5.59893 numMergedOcc 0
35 mol 141 unq 5 iso 0 dist 8.6387 9.33878 6.75376 12.7431 9.35867 3.89483 numMergedOcc 0
36 mol 141 unq 6 iso 0 dist 7.64956 8.69924 9.10042 11.2655 9.38036 3.89483 numMergedOcc 0
37 mol 141 unq 7 iso 0 dist 7.64956 9.41497 9.75059 11.2655 9.38036 4.1436 numMergedOcc 0
38 mol 141 unq 8 iso 0 dist 7.64956 9.53115 6.83404 11.2655 9.38036 12.6017 numMergedOcc 0
39 mol 194 unq 0 iso 0 dist 6.37788 8.43261 6.1886 8.68259 8.43182 13.0087 numMergedOcc 0
40 mol 194 unq 1 iso 0 dist 8.7028 13.8424 6.1886 9.38176 8.43182 13.0087 numMergedOcc 0
41 mol 232 unq 0 iso 0 dist 6.57921 7.86594 9.78181 6.20756 9.78273 12.3206 numMergedOcc 0
42 mol 232 unq 1 iso 0 dist 6.57921 13.8622 9.8664 6.20756 9.78273 12.159 numMergedOcc 0
43 mol 237 unq 0 iso 0 dist 5.06628 5.90415 8.10254 5.20161 8.95332 5.18809 numMergedOcc 0
44 mol 250 unq 0 iso 0 dist 5.93798 12.4255 9.70149 11.0798 9.25035 4.14699 numMergedOcc 0
45 mol 260 unq 0 iso 0 dist 7.99521 5.52447 9.32954 5.42399 6.49413 4.07425 numMergedOcc 0
46 mol 260 unq 1 iso 0 dist 7.99521 5.52447 9.32954 10.39 6.12343 9.82931 numMergedOcc 0
47 mol 260 unq 2 iso 0 dist 7.99521 5.52447 9.32954 9.79316 4.52405 9.36278 numMergedOcc 0
48 mol 274 unq 0 iso 0 dist 8.2997 5.36428 6.88827 13.6012 8.09181 8.87313 numMergedOcc 0
49 mol 274 unq 1 iso 0 dist 8.2997 14.986 9.16942 13.6012 8.09181 6.97575 numMergedOcc 0
