0 mol 98 unq 0 iso 0 dist 4.94406 5.0289 7.23884 13.8153 12.82 9.64383 15.9329 15.3281 12.0058 4.44979 numMergedOcc 0
1 mol 98 unq 1 iso 0 dist 7.2337 12.1337 7.23884 11.9765 12.82 9.64383 14.6415 15.3281 12.0058 4.44979 numMergedOcc 0
2 mol 119 unq 0 iso 0 dist 5.58734 6.83988 8.00003 14.5277 12.3661 8.95212 16.376 16.109 10.3457 6.13374 numMergedOcc 0
3 mol 119 unq 1 iso 0 dist 5.58734 6.83988 8.00003 14.5277 12.3661 8.95212 21.6305 19.5351 16.7975 9.08536 numMergedOcc 0
4 mol 143 unq 0 iso 0 dist 5.75595 11.2897 7.78652 13.1485 12.207 7.36975 6.50232 6.46089 6.01455 7.05845 numMergedOcc 0
5 mol 143 unq 1 iso 0 dist 5.75595 11.2897 7.78652 13.1485 12.207 7.36975 16.2451 13.204 5.44503 8.18023 numMergedOcc 0
6 mol 143 unq 2 iso 0 dist 5.75595 11.2897 7.78652 14.8595 10.0079 5.40637 16.2451 13.204 5.44503 7.46803 numMergedOcc 0
7 mol 167 unq 0 iso 0 dist 9.69399 12.5567 9.67741 13.2247 5.43662 7.20495 6.28495 7.80054 6.36909 9.1326 numMergedOcc 0
8 mol 167 unq 1 iso 0 dist 9.69399 12.5567 9.67741 11.7438 5.95858 7.02548 6.28495 7.80054 6.36909 7.30954 numMergedOcc 0
9 mol 219 unq 0 iso 0 dist 9.30312 10.0509 7.59632 8.38773 5.75906 4.33238 9.78352 11.4406 4.74167 7.30481 numMergedOcc 0
10 mol 238 unq 0 iso 0 dist 9.43474 5.0871 7.10685 9.53006 5.37176 9.07475 5.9436 12.5578 10.0613 9.82327 numMergedOcc 0
11 mol 238 unq 1 iso 0 dist 9.43474 5.0871 7.10685 6.83837 6.65214 6.99888 5.05105 10.1326 5.54325 5.43613 numMergedOcc 0
12 mol 238 unq 2 iso 0 dist 9.43474 5.0871 7.10685 6.83837 6.65214 6.99888 5.9436 12.5578 10.0613 7.06768 numMergedOcc 0
13 mol 259 unq 0 iso 0 dist 9.69025 11.8501 7.08526 13.565 4.47425 5.85442 15.1483 8.71497 5.79468 6.23661 numMergedOcc 0
14 mol 287 unq 0 iso 0 dist 8.9316 12.3119 9.65934 12.802 5.97664 7.45616 5.89971 5.59555 7.23534 8.59762 numMergedOcc 0
15 mol 288 unq 0 iso 0 dist 8.9316 12.3119 9.65934 12.802 5.97664 7.45616 5.89971 5.59555 7.23534 8.59762 numMergedOcc 0
16 mol 289 unq 0 iso 0 dist 8.9316 12.3119 9.65934 12.802 5.97664 7.45616 5.89971 5.59555 7.23534 8.59762 numMergedOcc 0
17 mol 292 unq 0 iso 0 dist 9.46421 7.70348 9.88863 11.5098 3.92782 9.74118 5.737 5.7131 5.98906 6.1905 numMergedOcc 0
