0 mol 7 unq 0 iso 0 dist 6.24628 5.93318 8.23909 11.3122 13.9246 5.83658 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.78518 8.14553 6.79478 14.3658 11.2336 6.97875 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 6.53191 5.40129 5.38191 7.32436 9.80109 8.62769 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 6.53191 5.40129 5.38191 11.471 8.65318 6.09782 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.92545 5.63684 6.48625 9.28075 6.55138 6.46655 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 9.2309 11.9105 9.90199 14.3995 7.45147 7.9097 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 9.2309 4.59504 9.74996 7.70037 7.48749 8.24121 numMergedOcc 0
7 mol 69 unq 2 iso 0 dist 9.2309 6.09189 8.21667 7.70037 7.48749 8.52371 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.76332 14.9119 9.02288 15.1303 14.4661 9.89021 numMergedOcc 0
9 mol 87 unq 0 iso 0 dist 7.67411 7.2527 8.50159 8.21588 6.69874 9.1329 numMergedOcc 0
10 mol 87 unq 1 iso 0 dist 7.67411 7.2527 8.50159 6.62798 3.66319 5.26938 numMergedOcc 0
11 mol 87 unq 2 iso 0 dist 7.67411 7.2527 8.50159 11.2078 7.58056 6.8014 numMergedOcc 0
12 mol 102 unq 0 iso 0 dist 8.63253 8.90571 9.01767 6.7095 11.7098 9.0361 numMergedOcc 0
13 mol 102 unq 1 iso 0 dist 5.15752 5.26061 9.43411 6.7095 5.51997 7.48277 numMergedOcc 0
14 mol 102 unq 2 iso 0 dist 5.15752 8.90571 9.80678 6.7095 5.51997 9.0361 numMergedOcc 0
15 mol 109 unq 0 iso 0 dist 8.35267 10.4339 6.31633 13.0961 5.74375 7.4371 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 8.90273 9.83765 6.86946 13.0215 5.14617 6.09472 numMergedOcc 0
17 mol 115 unq 1 iso 0 dist 8.90273 9.83765 6.86946 16.4236 11.6665 8.93552 numMergedOcc 0
18 mol 115 unq 2 iso 0 dist 8.90273 9.83765 6.86946 15.8136 9.9398 6.20658 numMergedOcc 0
19 mol 140 unq 0 iso 0 dist 9.69499 7.49203 9.93572 11.5101 8.91817 5.44596 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 8.32453 4.9475 5.46922 10.8949 4.81215 9.18691 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 8.32453 4.9475 5.46922 7.10839 7.13388 8.90592 numMergedOcc 0
22 mol 143 unq 2 iso 0 dist 8.13798 9.53356 5.46922 10.3508 4.81215 9.18691 numMergedOcc 0
23 mol 143 unq 3 iso 0 dist 8.13798 9.53356 5.46922 15.2481 7.13388 8.90592 numMergedOcc 0
24 mol 143 unq 4 iso 0 dist 5.25485 9.28974 5.46922 7.58683 4.81215 9.18691 numMergedOcc 0
25 mol 143 unq 5 iso 0 dist 5.25485 9.28974 5.46922 11.8407 7.13388 8.90592 numMergedOcc 0
26 mol 182 unq 0 iso 0 dist 9.68167 5.4214 7.86625 10.6194 4.39505 9.36307 numMergedOcc 0
27 mol 222 unq 0 iso 0 dist 8.81385 6.17038 8.7347 10.4296 4.56782 7.27481 numMergedOcc 0
28 mol 227 unq 0 iso 0 dist 7.60093 7.39364 9.18675 8.76741 11.1791 6.095 numMergedOcc 0
29 mol 235 unq 0 iso 0 dist 5.47932 10.5401 9.2433 11.6217 7.49961 7.93727 numMergedOcc 0
30 mol 236 unq 0 iso 0 dist 9.86445 10.5925 8.77254 10.5189 10.1358 6.73134 numMergedOcc 0
31 mol 261 unq 0 iso 0 dist 7.85381 5.09075 9.62828 8.36611 6.13416 7.15785 numMergedOcc 0
32 mol 273 unq 0 iso 0 dist 8.24507 12.0564 8.90885 7.29081 4.62586 6.54753 numMergedOcc 0
